Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | XPO1 | O14980 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3478352 | 0.84 | HSP90AA1 (0.49) | RAB9ACA2XPO1CYP2A6MGAM | |
| SCHEMBL5201465 | 0.78 | RAB9A (0.46) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL29239834 | 0.78 | CA2 (0.57) | RAB9ACA2CYP2A6NPC1CYP1A2 | |
| SCHEMBL3962610 | 0.75 | CYP2A6 (0.38) | RAB9ACYP2A6NPC1CYP1A2CYP3A4 | |
| SCHEMBL31009687 | 0.75 | CYP2A6 (0.38) | RAB9ACYP2A6NPC1CYP1A2CYP3A4 | |
| SCHEMBL18950282 | 0.74 | CA2 (0.40) | RAB9ACA2CYP2A6NPC1CYP1A2 | |
| SCHEMBL14761513 | 0.74 | RAB9A (0.36) | RAB9ACA2CYP2A6NPC1CYP1A2 | |
| SCHEMBL5202024 | 0.74 | RAB9A (0.39) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18878582 | 0.74 | CYP2A6 (0.41) | RAB9ACYP2A6NPC1CYP1A2CYP3A4 | |
| SCHEMBL147625 | 0.72 | TUBB4A (0.46) | CA2CYP2A6CYP1A2HDAC1TUBB4A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2167083-A2 | NOVEL 1- HETEROARYL-3-AZABICYCLOÝ3.1.0¨HEXANES, METHODS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | DOV Pharmaceutical, Inc. (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008153937-A2 | NOVEL 1- HETEROARYL-3-AZABICYCLO[3.1.0]HEXANES, METHODS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | DOV PHARMACEUTICAL, INC. (US) | 2008-12-18 | — | — | WO | disclosed |