Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | CD38 | P28907 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31589030 | 0.90 | CYP19A1 (0.55) | CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2 | |
| Hydrochloric Acid SCHEMBL17583816 | 0.88 | CYP19A1 (0.54) | CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2 | |
| SCHEMBL7649005 | 0.84 | CYP3A4 (0.50) | CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2 | |
| Hydrochloric Acid SCHEMBL28521741 | 0.83 | CYP3A4 (0.48) | CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2 | |
| SCHEMBL27677862 | 0.79 | TLR2 (0.46) | CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2 | |
| SCHEMBL8331908 | 0.77 | CYP3A4 (0.49) | CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2 | |
| SCHEMBL27551317 | 0.77 | CYP3A4 (0.43) | CYP11B1CYP11B2CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL10918314 | 0.77 | IDO1 (0.54) | CYP11B1CYP11B2CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL28021153 | 0.77 | LMNA (0.44) | CYP11B1CYP11B2CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL31149024 | 0.75 | CYP19A1 (0.67) | CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999009845-A1 | IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-03-04 | — | — | WO | claimed |