Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.30 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31549962 | 0.85 | SIGMAR1 (0.35) | SIGMAR1NPSR1PLA2G1BPLA2G2A | |
| SCHEMBL10873427 | 0.81 | SPHK1 (0.40) | PLA2G1BPLA2G2ACYP1A2HSD17B10 | |
| SCHEMBL2845490 | 0.74 | SIGMAR1 (0.35) | SIGMAR1NPSR1CYP1A2CYP2C9HPGD | |
| SCHEMBL19052321 | 0.74 | — | — | |
| SCHEMBL7103686 | 0.72 | PLA2G1B (0.33) | SIGMAR1NPSR1PLA2G1BPLA2G2ACYP1A2 | |
| Monoethanolamine SCHEMBL8747970 | 0.71 | ALDH1A1 (0.40) | SIGMAR1NPSR1CYP1A2CYP2C9HPGD | |
| SCHEMBL7769249 | 0.71 | TDP1 (0.36) | CYP2C9 | |
| SCHEMBL28782515 | 0.70 | DNM1 (0.38) | PLA2G1BPLA2G2ACYP1A2 | |
| Diethylaminoethanol SCHEMBL2788218 | 0.70 | CYP1A2 (0.46) | NPSR1CYP1A2CYP2C9HPGDMAPK1 | |
| SCHEMBL24784722 | 0.70 | LMNA (0.46) | PLA2G1BPLA2G2ACYP1A2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1092737-B1 | Catalyst composition for the production of a polyurethane resin, and method for producing a polyurethane resin | TOSOH CORP (JP) | 2003-09-24 | — | — | EP | disclosed |