Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9009463 | 0.83 | AHR (0.47) | AHRCYP1B1DHFRNPC1RAB9A | |
| SCHEMBL6841249 | 0.83 | AHR (0.47) | AHRCYP1B1DHFRNPC1RAB9A | |
| SCHEMBL2428032 | 0.79 | PTGS2 (0.36) | AHRNOTUMAKR1C3AKR1C2 | |
| SCHEMBL435758 | 0.79 | AHR (0.42) | AHRNPC1RAB9AKDM4ETP53 | |
| SCHEMBL9649088 | 0.79 | LMNA (0.33) | AHRHTTTP53AKR1C3AKR1C2 | |
| SCHEMBL10413691 | 0.79 | AHR (0.41) | AHRDHFR | |
| SCHEMBL1135190 | 0.78 | — | — | |
| SCHEMBL9648712 | 0.77 | TDO2 (0.40) | DHFRNPC1RAB9ANOTUMMEN1 | |
| SCHEMBL28822926 | 0.76 | MAPK1 (0.33) | MAPTMEN1GAAKMT2ATP53 | |
| SCHEMBL5899213 | 0.76 | HPGD (0.35) | KDM4EMAPTMEN1KMT2AAKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5571808-A | SUBSTITUTED 2-ARYL-3-AROYLBENZO(B)THIOPHENES | ELI LILLY AND COMPANY (US) | 1996-11-05 | — | — | US | disclosed |