Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4650676 | 0.79 | ALDH1A1 (0.48) | TDP1CYP2A6KDM4EALDH1A1RAB9A | |
| SCHEMBL11479229 | 0.79 | KDM4E (0.48) | TDP1CYP2A6KDM4EALDH1A1RAB9A | |
| SCHEMBL11696316 | 0.79 | ALDH1A1 (0.42) | CYP2A6KDM4EALDH1A1RAB9AMAPT | |
| SCHEMBL31259136 | 0.79 | BRD4 (0.45) | TDP1CYP2A6KDM4EALDH1A1RAB9A | |
| SCHEMBL26261539 | 0.79 | NPC1 (0.53) | KDM4EALDH1A1RAB9AMAPTKMT2A | |
| SCHEMBL11234082 | 0.79 | ALDH1A1 (0.48) | TDP1CYP2A6KDM4EALDH1A1RAB9A | |
| SCHEMBL6177668 | 0.79 | TYR (0.44) | CYP2A6KDM4EALDH1A1RAB9AMAPT | |
| SCHEMBL28596237 | 0.77 | KDM4E (0.38) | TDP1CYP2A6KDM4EALDH1A1RAB9A | |
| SCHEMBL14829741 | 0.77 | TGFBR1 (0.42) | TDP1CYP2A6KDM4EALDH1A1RAB9A | |
| SCHEMBL11470047 | 0.74 | ALDH1A1 (0.55) | TDP1KDM4EALDH1A1MAPTHPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1015262-B | The method for preparing β-Nei Xiananleikangshengsu | BAYER AG (DE) | 1992-01-01 | — | — | CN | disclosed |
| EP-0197294-B1 | BETA-LACTAM ANTIBIOTICS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | BAYER AG (DE) | 1991-04-03 | — | — | EP | disclosed |
| US-4734407-A | ANIMAL GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1988-03-29 | — | — | US | disclosed |
| EP-0197294-A2 | Beta-lactam antibiotics, process for their preparation and their use as medicaments | BAYER AG (DE) | 1986-10-15 | — | — | EP | disclosed |
| CN-86101695-A | Prepare the method for β-Nei Xiananleikangshengsu and the application in medicine thereof | — | 1986-09-10 | — | — | CN | disclosed |