Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 6/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 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 | |
|---|---|---|---|---|
| SCHEMBL1033446 | 0.88 | NPC1 (0.53) | HIF1ATP53NPC1RAB9AKMT2A | |
| SCHEMBL1030364 | 0.83 | MCHR1 (0.47) | TP53NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL1028662 | 0.80 | LMNA (0.48) | TP53NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL1031916 | 0.79 | NPSR1 (0.51) | MAPK1TSHR | |
| SCHEMBL2637504 | 0.77 | HPGD (0.47) | TP53NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL1032095 | 0.77 | CDK4 (0.56) | NPC1RAB9AKMT2AKDM4EMEN1 | |
| SCHEMBL1032186 | 0.75 | ALDH1A1 (0.46) | NPC1RAB9AKMT2AKDM4EMEN1 | |
| SCHEMBL1031782 | 0.75 | CYP3A4 (0.45) | TP53NPC1RAB9AKMT2AKDM4E | |
| SCHEMBL1028135 | 0.74 | ALDH1A1 (0.53) | TP53KMT2AKDM4EALDH1A1THRB | |
| SCHEMBL1032118 | 0.74 | POLB (0.40) | TP53AGTR1NPC1RAB9AKMT2A |
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-2035375-B1 | 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2011-01-19 | — | — | EP | claimed |