Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1RN | P18510 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL30958859 | 0.84 | CYP2C9 (0.56) | KEAP1ALDH1A1GAAHTTGFER | |
| SCHEMBL4550969 | 0.84 | CA1 (0.43) | GAAHTTSMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL13953984 | 0.84 | LMNA (0.41) | ALDH1A1GAAHTTRECQLSMN1; SMN2 | |
| SCHEMBL4550968 | 0.76 | ALDH1A1 (0.52) | ALDH1A1HTTKMT2AMEN1PKM | |
| SCHEMBL532975 | 0.74 | ACLY (0.69) | ALDH1A1GAAHTTKMT2AMEN1 | |
| SCHEMBL7663530 | 0.73 | ALDH1A1 (0.59) | IL1RNKEAP1ERAP1ALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL533067 | 0.73 | ACLY (0.68) | ALDH1A1GAAHTTKMT2AMEN1 | |
| SCHEMBL8459483 | 0.73 | CYP2C9 (0.76) | IL1RNKEAP1ERAP1ALDH1A1GAA | |
| SCHEMBL2067538 | 0.72 | ALDH1A1 (0.68) | IL1RNKEAP1ERAP1ALDH1A1GAA | |
| SCHEMBL533066 | 0.72 | ACLY (0.58) | IL1RNKEAP1ERAP1ALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-7579340-B2 | Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists | PFIZER INC (US) | 2009-08-25 | — | — | US | disclosed |