Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | CHUK | O15111 | 1/20 | 0.52 |
| ▸ | PARP1 | P09874 | 6/20 | 0.48 |
| ▸ | ERN1 | O75460 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1805788 | 1.00 | LCK (0.55) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL1806660 | 0.87 | KDM4E (0.59) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL1806853 | 0.87 | KDM4E (0.59) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL29803190 | 0.85 | PKM (0.52) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL322274 | 0.85 | PKM (0.52) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL28379539 | 0.84 | LCK (0.48) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL31753888 | 0.82 | CHUK (0.45) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL31753892 | 0.82 | CHUK (0.45) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL9307908 | 0.82 | CHUK (0.45) | LCKKDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL926368 | 0.82 | LCK (0.55) | LCKKDM4EALDH1A1TSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-4268510-A | DEMETHANIZATION, METABOLISM, RUMEN | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1981-05-19 | — | — | US | disclosed |
| EP-0010348-A1 | Heterocyclic trichloromethyl derivatives, process for their preparation and their use | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1980-04-30 | — | — | EP | disclosed |