Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.33 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.33 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.33 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.33 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
| ▸ | ACLY | P53396 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10803680 | 0.82 | ALDH1A1 (0.34) | ALDH1A1PKMDAOHPGDCYP3A4 | |
| SCHEMBL10799082 | 0.78 | ALDH1A1 (0.34) | ALDH1A1PKMDAOLMNAERCC1 | |
| SCHEMBL10804992 | 0.76 | ALDH1A1 (0.38) | ALDH1A1PKMDAOHPGDLMNA | |
| SCHEMBL10798760 | 0.75 | DYRK1A (0.40) | ALDH1A1PKMDAOCYP3A4LMNA | |
| SCHEMBL10799602 | 0.72 | ALDH1A1 (0.33) | ALDH1A1PKMLMNA | |
| SCHEMBL17362093 | 0.70 | ACLY (0.42) | ALDH1A1DAOHPGDTSHRLMNA | |
| SCHEMBL10801923 | 0.70 | DAO (0.34) | ALDH1A1PKMDAOHPGDCYP3A4 | |
| SCHEMBL6986501 | 0.69 | DAO (0.40) | ALDH1A1PKMDAOHPGDLMNA | |
| SCHEMBL10679161 | 0.69 | NOTUM (0.44) | DAONOTUM | |
| SCHEMBL10804999 | 0.68 | MEN1 (0.32) | ALDH1A1DAOHPGDCYP3A4ALOX15 |
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-0216541-A1 | Aryl pyridones | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-04-01 | — | — | EP | claimed |