Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 6/20 | 0.69 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.56 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9651986 | 0.90 | ABCB1 (0.65) | ABCB1KCNK3KCNK9CYP3A4CYP2C9 | |
| SCHEMBL9651954 | 0.86 | NPC1 (0.58) | ABCB1CYP3A4CYP2C9KMT2AMEN1 | |
| SCHEMBL8180270 | 0.86 | POLB (0.68) | CYP3A4CYP2C9KMT2AMEN1POLB | |
| SCHEMBL9714226 | 0.84 | ABCB1 (0.89) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9651158 | 0.82 | MAPT (0.60) | ABCB1CYP3A4CYP2C9KMT2AMEN1 | |
| SCHEMBL8178344 | 0.82 | ABCB1 (0.84) | ABCB1CYP3A4CYP2C9SMN1; SMN2POLB | |
| SCHEMBL10721518 | 0.82 | ABCB1 (1.00) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9651118 | 0.81 | ABCB1 (0.66) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9714197 | 0.81 | ABCB1 (0.82) | ABCB1CYP3A4CYP2C9SMN1; SMN2POLB | |
| SCHEMBL9652311 | 0.81 | ABCB1 (0.73) | ABCB1CYP3A4CYP2C9POLB |
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-0261755-B1 | FIVE-MEMBERED HETEROCYCLIC DERIVATIVES OF N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES | ROHM AND HAAS COMPANY (US) | 1992-12-16 | — | — | EP | disclosed |