Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.73 |
| ▸ | CASP1 | P29466 | 14/20 | 0.63 |
| ▸ | CASP5 | P51878 | 13/20 | 0.63 |
| ▸ | CASP4 | P49662 | 11/20 | 0.63 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.51 |
| ▸ | GBA1 | P04062 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9639434 | 0.98 | KMT2A (0.71) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9755198 | 0.91 | CASP1 (0.60) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9133699 | 0.88 | CASP1 (0.58) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9689152 | 0.88 | CASP1 (0.58) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9689535 | 0.88 | CASP1 (0.58) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9690413 | 0.88 | CASP1 (0.58) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9128566 | 0.88 | CASP1 (0.58) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL9689155 | 0.87 | CASP1 (0.56) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL9689562 | 0.87 | CASP1 (0.56) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL9689522 | 0.87 | CASP1 (0.56) | MEN1KMT2ACYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991006542-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1991-05-16 | — | — | WO | claimed |