Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL22395344 | 0.98 | CYP19A1 (0.48) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL10674648 | 0.86 | LOXL2 (0.42) | CYP19A1MAOBF2F10CA12 | |
| SCHEMBL15708027 | 0.85 | LOXL2 (0.58) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL29988206 | 0.85 | LOXL2 (0.58) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL11190838 | 0.82 | CYP19A1 (0.49) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL361904 | 0.79 | CYP19A1 (0.53) | CYP19A1MAOBKDM4ECA12CA1 | |
| SCHEMBL29779144 | 0.79 | CYP19A1 (0.53) | CYP19A1MAOBKDM4ECA12CA1 | |
| SCHEMBL2331524 | 0.79 | KMT2A (0.55) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL10729516 | 0.79 | F2 (0.46) | MAOBF2F10CA12CA1 | |
| SCHEMBL8950183 | 0.79 | CYP19A1 (0.49) | CYP19A1F2F10CA12CA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5814669-A | REACTING A PHENETHYLAMINE WITH 4-ISOPROPYL-2,5-OXAZOLIDINEDIONE; APPLYING TO PLANT, SOIL OR SEED | BAYER AKTIENGESELLSCHAFT (DE) | 1998-09-29 | — | — | US | disclosed |
| EP-0767780-A1 | AMINO ACID DERIVATIVES AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 1997-04-16 | — | — | EP | disclosed |
| WO-1996000718-A1 | AMINO ACID DERIVATIVES AND THEIR USE AS PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-01-11 | — | — | WO | disclosed |
| EP-0283522-B1 | TRIAZINE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING SAME AS EFFECTIVE INGREDIENT | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1991-02-27 | — | — | EP | disclosed |