Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.45 |
| ▸ | CA2 | P00918 | 5/20 | 0.45 |
| ▸ | ESR1 | P03372 | 4/20 | 0.45 |
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA7 | P43166 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL4006994 | 0.94 | TAS1R3 (0.47) | CA1CA2ESR1CA12CA7 | |
| SCHEMBL17230529 | 0.88 | ESR1 (0.56) | CA1CA2ESR1CA12CA7 | |
| 4-Vinylphenol SCHEMBL6907592 | 0.86 | CA1 (0.38) | CA1CA2ESR1CA12CA7 | |
| 4-Vinylphenol SCHEMBL6903536 | 0.85 | MIF (0.47) | CA1CA2ESR1CA12CA7 | |
| SCHEMBL24948271 | 0.82 | CYP1A2 (0.50) | CA1CA2ESR1CA12CA7 | |
| SCHEMBL5366422 | 0.81 | CYP1A2 (0.49) | CA1CA2ESR1CA12CA7 | |
| SCHEMBL24948260 | 0.81 | TAS1R3 (0.42) | CA1CA2CA12CA9CA14 | |
| SCHEMBL9312279 | 0.80 | TAS1R3 (0.44) | CA1CA2ESR1CA12CA7 | |
| SCHEMBL5449149 | 0.80 | MAOB (0.33) | CA1CA2ESR1CA12CA7 | |
| SCHEMBL24948273 | 0.79 | TAS1R3 (0.41) | CA1CA2CA12CA9CA14 |
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-20040260031-A1 | Preparation of polymer and resist composition | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2004-12-23 | — | — | US | disclosed |