Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 6/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 6/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.39 |
| ▸ | RECQL | P46063 | 5/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11158381 | 0.84 | SCN4A (0.45) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| SCHEMBL26492524 | 0.82 | ADRB2 (0.41) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| SCHEMBL5316260 | 0.77 | MAOA (0.42) | PTGS2HSD17B10HIF1AALDH1A1CYP3A4 | |
| SCHEMBL19890916 | 0.77 | MAOA (0.49) | PTGS2ALDH1A1KMT2AMAPTMEN1 | |
| SCHEMBL27360487 | 0.76 | SIRT1 (0.30) | — | |
| SCHEMBL20495593 | 0.75 | CYP3A4 (0.50) | CYP3A4CYP1A2CYP2C19CYP2C9HTR2A | |
| SCHEMBL8007165 | 0.74 | ALOX15 (0.38) | SLC6A3KDM4EALOX15HSD17B10MAPK1 | |
| SCHEMBL8007169 | 0.74 | ALOX15 (0.38) | SLC6A3KDM4EALOX15HSD17B10MAPK1 | |
| SCHEMBL14017008 | 0.73 | HPGD (0.45) | KDM4EALDH1A1HPGDKMT2ALMNA | |
| SCHEMBL23344444 | 0.73 | CA1 (0.38) | ADRB2PTGS2KDM4EHIF1AMAPK1 |
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 |