Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.45 |
| ▸ | AXL | P30530 | 1/20 | 0.42 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | SIRT3 | Q9NTG7 | 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 | |
|---|---|---|---|---|
| SCHEMBL27768495 | 0.82 | HSD11B1 (0.45) | ALDH1A1RAB9AMAPTHPGDSMN1; SMN2 | |
| SCHEMBL15062621 | 0.81 | CES1 (0.38) | CYP3A4CYP2C9CYP2C19CYP2D6CYP1A2 | |
| SCHEMBL9346559 | 0.76 | CYP2A6 (0.54) | CYP3A4CYP2E1CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL13984428 | 0.76 | HSP90AA1 (0.53) | CYP3A4CYP2E1CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL6194452 | 0.73 | CYP3A4 (0.55) | CYP3A4CYP2E1CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL27768689 | 0.73 | CYP2A6 (0.45) | CYP3A4CYP2A6ALDH1A1CYP1A2CYP19A1 | |
| SCHEMBL6821852 | 0.72 | HDAC1 (0.37) | ALDH1A1METAP2NPC1RAB9AKDM4E | |
| SCHEMBL24623245 | 0.72 | ADRB2 (0.50) | CYP3A4CYP2E1CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL4376192 | 0.72 | RAB9A (0.65) | ALDH1A1NPC1RAB9AKDM4ETP53 | |
| SCHEMBL28756282 | 0.72 | MKNK1 (0.50) | CYP3A4CYP2A6ALDH1A1CYP1A2CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102850324-A | Indole compounds | MICROBIA INC | 2013-01-02 | — | — | CN | disclosed |
| CN-101563337-A | Indole compounds | MICROBIA INC (US) | 2009-10-21 | — | — | CN | disclosed |