Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 6/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.36 |
| ▸ | TDP2 | O95551 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16890713 | 0.97 | CYP11B1 (0.41) | CYP11B1CYP11B2CYP19A1CYP17A1MKNK1 | |
| SCHEMBL16890026 | 0.94 | CYP11B1 (0.46) | CYP11B1CYP11B2CYP19A1CYP17A1MKNK1 | |
| SCHEMBL16890496 | 0.92 | CYP11B1 (0.41) | CYP11B1CYP11B2CYP19A1CYP17A1MKNK1 | |
| SCHEMBL16890702 | 0.90 | PIK3CA (0.39) | MKNK1PIM1PIK3CAS1PR1 | |
| SCHEMBL16889281 | 0.89 | CA12 (0.33) | KDM4ENPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL16890462 | 0.88 | CYP11B1 (0.40) | CYP11B1CYP11B2CYP19A1CYP17A1MKNK1 | |
| SCHEMBL16890468 | 0.87 | S1PR1 (0.38) | CYP11B1CYP11B2CYP19A1CYP17A1CYP1A2 | |
| SCHEMBL20375763 | 0.86 | CYP11B1 (0.41) | CYP11B1CYP11B2CYP19A1CYP17A1MKNK1 | |
| SCHEMBL16889985 | 0.86 | CYP11B1 (0.44) | CYP11B1CYP11B2CYP19A1CYP17A1MKNK1 | |
| SCHEMBL16890913 | 0.86 | CYP11B1 (0.46) | CYP11B1CYP11B2CYP19A1CYP17A1MKNK1 |
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-2015102118-A1 | POLYCYCLIC AROMATIC COMPOUND | 学校法人関西学院 | 2015-07-09 | — | — | WO | disclosed |