Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CDK7 | P50613 | 1/20 | 0.41 |
| ▸ | CCNH | P51946 | 1/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2973941 | 0.85 | GAA (0.47) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL7071544 | 0.83 | LMNA (0.52) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL27512101 | 0.81 | ALPL (0.40) | GAAKMT2AMEN1ALDH1A1CYP3A4 | |
| SCHEMBL3844084 | 0.81 | MEN1 (0.41) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL3839443 | 0.78 | MEN1 (0.43) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL6935683 | 0.78 | KMT2A (0.51) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL8499995 | 0.77 | MEN1 (0.38) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL7475140 | 0.77 | MEN1 (0.38) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL64533 | 0.76 | KMT2A (0.62) | GAAKMT2AMEN1ESR1ESR2 | |
| SCHEMBL15453749 | 0.75 | KMT2A (0.37) | GAAKMT2AMEN1NFE2L2ALDH1A1 |
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-5013756-A | Catechol derivatives, a process of preparation thereof, and therapeutical compositions containing the same | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATION SCIENTIFIQUES (S.C.R.A.S) (FR) | 1991-05-07 | — | — | US | disclosed |