Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | CTSC | P53634 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11565761 | 0.78 | TRPA1 (0.41) | CYP1A2MAOBTAAR1MAOAALDH1A1 | |
| SCHEMBL11566830 | 0.78 | CYP19A1 (0.48) | MAOBMAOACYP2A6ALDH1A1 | |
| SCHEMBL11133642 | 0.78 | ALDH1A1 (0.41) | CYP1A2MAOBMAOASLC6A4ALDH1A1 | |
| SCHEMBL11565407 | 0.78 | CYP1A2 (0.41) | CYP1A2CYP1A1CYP1B1CTSCSIGMAR1 | |
| SCHEMBL8499045 | 0.78 | PNMT (0.55) | TAAR1 | |
| SCHEMBL3992863 | 0.77 | CYP1A2 (0.45) | CYP1A2EPHX1TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL8495801 | 0.77 | MIF (0.46) | TAAR1ALDH1A1 | |
| SCHEMBL6479259 | 0.77 | ANPEP (0.49) | ALDH1A1ANPEP | |
| SCHEMBL1343851 | 0.76 | EPHX1 (0.48) | CYP1A2CYP1A1CYP1B1EPHX1MAOB | |
| SCHEMBL4656441 | 0.76 | EPHX1 (0.48) | CYP1A2CYP1A1CYP1B1EPHX1MAOB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0392286-B1 | 3-Cyano-4-phenyl-pyrrole derivatives | BAYER AG (DE) | 1993-11-18 | — | — | EP | claimed |
| EP-0318704-B1 | 3-CYANO-4-PHENYL-PYRROLE DERIVATIVES | BAYER AG (DE) | 1992-12-02 | — | — | EP | claimed |
| EP-0392286-A1 | 3-Cyano-4-phenyl-pyrrole derivatives | BAYER AG (DE) | 1990-10-17 | — | — | EP | claimed |
| EP-0315869-A2 | 3-Cyano-4-(2,4-difluor-3-phenyl)-pyrrole | BAYER AG (DE) | 1989-05-17 | — | — | EP | claimed |
| JP-56079661-A | — | — | None | — | — | JP | disclosed |
| CN-112941655-B | Nano-fiber bilirubin adsorbent and preparation method thereof | 东北师范大学 | 2022-05-13 | — | — | CN | disclosed |
| CN-112941655-A | Nano-fiber bilirubin adsorbent and preparation method thereof | 东北师范大学 | 2021-06-11 | — | — | CN | disclosed |
| CN-103539659-B | 2,4-benzoic acid dibenzyl derivative and preparation method thereof and application | SOUTHEAST UNIVERSITY (CN) | 2015-11-18 | — | — | CN | disclosed |
| EP-0315862-B1 | Aromatically fluorinated fluoromethoxy- and fluoromethylthio-amino benzenes and their preparation | BAYER AG (DE) | 1994-04-13 | — | — | EP | disclosed |
| EP-0315863-B1 | Trifluoromethylamino benzenes containing fluorine, and their preparation | BAYER AG (DE) | 1993-11-18 | — | — | EP | disclosed |
| EP-0392286-B1 | 3-Cyano-4-phenyl-pyrrole derivatives | BAYER AG (DE) | 1993-11-18 | — | — | EP | disclosed |
| EP-0318781-B1 | ALKOXYANILINES CONTAINING FLUORINE ATOMS ON THE AROMATIC RING AND ON THE SIDE CHAINS AND PROCESS FOR THE PREPARATION OF ALKOXYANILINES CONTAINING FLUORINE ATOMS ON THE AROMATIC RING AND ON THE SIDE CHAIN | BAYER AG (DE) | 1993-06-23 | — | — | EP | disclosed |
| US-4502999-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-03-05 | — | — | US | disclosed |
| US-4503000-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-03-05 | — | — | US | disclosed |
| US-4502996-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-03-05 | — | — | US | disclosed |
| US-4502995-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-03-05 | — | — | US | disclosed |
| US-4502998-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-03-05 | — | — | US | disclosed |
| US-4499026-A | Nucleophilic substitution process | ETHYL CORPORATION (US) | 1985-02-12 | — | — | US | disclosed |
| EP-0078709-A2 | Preparation of nitroaralkyl cyanides and derivatives thereof | ETHYL CORPORATION (US) | 1983-05-11 | — | — | EP | disclosed |
| JP-S5679661-A | PREPARATION OF ALPHA-CHLOROHYDROCINNAMNITRILE | TOYO SODA MFG CO LTD | 1981-06-30 | — | — | JP | disclosed |