Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.64 |
| ▸ | CA2 | P00918 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.46 |
| ▸ | FYN | P06241 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL17060490 | 0.88 | CA1 (0.82) | CA1CA2ALDH1A1CYP3A4TDP1 | |
| SCHEMBL15445310 | 0.81 | CA1 (0.70) | CA1CA2ALDH1A1TDP1TP53 | |
| SCHEMBL17220670 | 0.81 | CA1 (0.70) | CA1CA2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL278774 | 0.81 | CA1 (0.70) | CA1CA2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL503537 | 0.81 | CA1 (0.70) | CA1CA2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL220910 | 0.80 | CA1 (1.00) | CA1CA2ALDH1A1CYP3A4TDP1 | |
| SCHEMBL22804025 | 0.80 | CA1 (1.00) | CA1CA2ALDH1A1CYP3A4TDP1 | |
| SCHEMBL8953908 | 0.79 | CYP3A4 (0.52) | CA1CA2ALDH1A1CYP3A4TDP1 | |
| SCHEMBL9579782 | 0.77 | CA1 (0.64) | CA1CA2ALDH1A1CYP3A4FYN | |
| SCHEMBL8552828 | 0.77 | CA1 (0.64) | CA1CA2ALDH1A1CYP1A2CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180119279-A1 | PROCESS FOR PRODUCING FLEXIBLE ORGANIC-INORGANIC LAMINATES | BASF COATINGS GMBH (DE) | 2018-05-03 | — | — | US | disclosed |
| US-20180119279-A1 | PROCESS FOR PRODUCING FLEXIBLE ORGANIC-INORGANIC LAMINATES | BASF COATINGS GMBH (DE) | 2018-05-03 | — | — | US | disclosed |