Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | CRHBP | P24387 | 2/20 | 0.48 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL9585493 | 0.88 | HTT (0.65) | HTTALDH1A1KDM4EHPGDCRHBP | |
| SCHEMBL9846091 | 0.84 | ALDH1A1 (0.53) | HTTALDH1A1KDM4EHPGDCRHBP | |
| SCHEMBL9846090 | 0.82 | KDM4E (0.69) | HTTALDH1A1KDM4EHPGDCRHBP | |
| SCHEMBL15132081 | 0.80 | MAOB (0.48) | HTTALDH1A1SMN1; SMN2POLBTDP1 | |
| SCHEMBL9846135 | 0.78 | L3MBTL1 (0.44) | HTTALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL9586720 | 0.78 | ALDH1A1 (0.48) | HTTALDH1A1KDM4EHPGDCRHBP | |
| SCHEMBL9846264 | 0.76 | CNR1 (0.47) | HTTALDH1A1KDM4EHPGDCRHBP | |
| SCHEMBL23120426 | 0.74 | CYP1A2 (0.51) | HTTALDH1A1KDM4EHPGDCRHBP | |
| SCHEMBL23135737 | 0.74 | CYP1A2 (0.58) | HTTALDH1A1KDM4EHPGDCRHBP | |
| SCHEMBL4286787 | 0.73 | HDAC1 (0.58) | CNR1L3MBTL1SQORMAOBXDH |
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-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |