Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 1/20 | 0.46 |
| ▸ | FADS1 | O60427 | 1/20 | 0.46 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | CTSV | O60911 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL5233678 | 0.85 | RAB9A (0.56) | CYP1A2NPC1MAPK1RAB9ATACR1 | |
| SCHEMBL29987166 | 0.84 | CYP1A2 (0.61) | CYP1A2NPC1MAPK1RAB9ALOXL2 | |
| SCHEMBL5239658 | 0.84 | CYP1A2 (0.61) | CYP1A2NPC1MAPK1RAB9ALOXL2 | |
| SCHEMBL5231753 | 0.84 | CYP1A2 (0.53) | CYP1A2NPC1RAB9ALOXL2KDM4E | |
| SCHEMBL5233929 | 0.82 | CYP1A2 (0.50) | CYP1A2PSMD14NPC1MAPK1RAB9A | |
| SCHEMBL5241399 | 0.81 | FADS1 (0.46) | CYP1A2PSMD14NPC1MAPK1RAB9A | |
| SCHEMBL5241402 | 0.81 | FADS1 (0.46) | CYP1A2PSMD14NPC1MAPK1RAB9A | |
| SCHEMBL5233508 | 0.81 | CNR2 (0.53) | CYP1A2NPC1RAB9AALDH1A1FLT1 | |
| SCHEMBL9033128 | 0.78 | NPC1 (0.50) | PSMD14NPC1MAPK1RAB9ACTDSP1 | |
| SCHEMBL5239559 | 0.78 | KAT6A (0.44) | CYP1A2KDRMEN1KMT2A |
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-1397364-B1 | NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | LILLY CO ELI (US) | 2007-07-25 | — | — | EP | disclosed |