Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | CHUK | O15111 | 1/20 | 0.30 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.30 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.30 |
| ▸ | PRKCG | P05129 | 1/20 | 0.30 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | PIM1 | P11309 | 1/20 | 0.30 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | AKT1 | P31749 | 1/20 | 0.30 |
| ▸ | AKT2 | P31751 | 1/20 | 0.30 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.30 |
| ▸ | BLK | P51451 | 1/20 | 0.30 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16369064 | 1.00 | CYP1A2 (0.30) | CYP1A2CYP19A1CYP2C9CYP2C19CHUK | |
| SCHEMBL20853538 | 0.99 | CHUK (0.32) | CYP1A2CYP19A1CYP2C9CYP2C19CHUK | |
| SCHEMBL15037538 | 0.99 | CHUK (0.32) | CYP1A2CYP19A1CYP2C9CYP2C19CHUK | |
| SCHEMBL15018684 | 0.98 | CYP1A2 (0.32) | CYP1A2CYP19A1CYP2C9CYP2C19NPC1 | |
| SCHEMBL15018604 | 0.98 | CYP1A2 (0.32) | CYP1A2CYP19A1CYP2C9CYP2C19NPC1 | |
| SCHEMBL15018630 | 0.95 | CYP2C9 (0.32) | CYP2C9NPC1MAPTRAB9A | |
| SCHEMBL16369058 | 0.95 | CYP2C9 (0.32) | CYP2C9NPC1MAPTRAB9A | |
| SCHEMBL20853528 | 0.94 | NPC1 (0.36) | CYP1A2CYP19A1CYP2C9CYP2C19NPC1 | |
| SCHEMBL15037472 | 0.94 | NPC1 (0.36) | CYP1A2CYP19A1CYP2C9CYP2C19NPC1 | |
| SCHEMBL15037448 | 0.94 | NPC1 (0.36) | CYP1A2CYP19A1CYP2C9CYP2C19NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2791250-B1 | PARTICULAR AZOMETHINE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH COMPOUND, IMPLEMENTATION PROCESS THEREFORE AND USE THEREOF | OREAL (FR) | 2019-04-03 | — | — | EP | claimed |