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 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL123488 | 0.85 | CYP19A1 (0.51) | CYP19A1MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL8717811 | 0.82 | CYP19A1 (0.49) | CYP19A1MAOBF2F10KDM4E | |
| Hydrochloric Acid SCHEMBL22395344 | 0.81 | CYP19A1 (0.48) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL29779144 | 0.79 | CYP19A1 (0.53) | CYP19A1MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL361904 | 0.79 | CYP19A1 (0.53) | CYP19A1MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL2331524 | 0.79 | KMT2A (0.55) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL8895618 | 0.78 | MMP2 (0.50) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL8895635 | 0.78 | MAOB (0.47) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL10422458 | 0.78 | IDO1 (0.53) | CYP19A1MAOBF2F10KDM4E | |
| SCHEMBL2090815 | 0.78 | CYP19A1 (0.51) | CYP19A1MAOBKDM4EGPR35ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4402968-A | Antifungal benzofuranyl imidazole compounds | HOFFMANN-LA ROCHE INC. (US) | 1983-09-06 | — | — | US | disclosed |