Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 2/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10830858 | 0.82 | CYP3A4 (0.32) | CYP3A4TSHRTDP1AHRGFER | |
| SCHEMBL12535529 | 0.79 | CYP3A4 (0.33) | CYP3A4TSHRTDP1AHRGFER | |
| SCHEMBL12535526 | 0.79 | CYP3A4 (0.39) | CYP3A4TSHRTDP1AHRGFER | |
| SCHEMBL642403 | 0.76 | TSHR (0.47) | CYP3A4TSHRTDP1AHRGABRA1 | |
| SCHEMBL957652 | 0.76 | CYP3A4 (0.40) | CYP3A4SLC6A4 | |
| SCHEMBL2918852 | 0.71 | MEN1 (0.36) | CYP3A4TSHRTDP1GFERGABRA1 | |
| SCHEMBL27996378 | 0.71 | CYP2D6 (0.45) | CYP3A4TSHRTDP1GFERGABRA1 | |
| SCHEMBL2919093 | 0.71 | CYP3A4 (0.59) | CYP3A4TSHRTDP1GFERGABRA1 | |
| SCHEMBL11222378 | 0.71 | HSD17B10 (0.47) | TSHRHTTPRNPNPSR1 | |
| SCHEMBL18541221 | 0.71 | — | — |
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-20140275429-A1 | METHOD FOR PRODUCING OLEFIN BLOCK POLYMER USING PLURALITY OF TYPES OF TRANSITION METAL CATALYSTS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-09-18 | — | — | US | disclosed |