Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | CASP1 | P29466 | 1/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.58 |
| ▸ | CPN1 | P15169 | 1/20 | 0.47 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9804160 | 0.91 | CYP3A4 (0.48) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL17508795 | 0.91 | CYP3A4 (0.48) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL4073301 | 0.86 | CA1 (0.58) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL16424114 | 0.83 | CYP3A4 (0.58) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL17463865 | 0.81 | CYP3A4 (0.55) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL29237064 | 0.81 | CYP3A4 (0.55) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL17064637 | 0.80 | CA1 (0.57) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL17468939 | 0.79 | CYP3A4 (0.52) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL11617211 | 0.79 | CYP3A4 (0.52) | CYP3A4CASP1RECQLCPN1CPB2 | |
| SCHEMBL272384 | 0.79 | CYP3A4 (0.52) | CYP3A4CASP1RECQLCPN1CPB2 |
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-20230331927-A1 | POLYMETALLOXANE-CONTAINING COMPOSITION, CURED BODY, MEMBER, ELECTRONIC COMPONENT, AND FIBER | TORAY INDUSTRIES, INC. (JP) | 2023-10-19 | — | — | US | disclosed |