Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.30 |
| ▸ | PLA2G2A | P14555 | 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 | |
|---|---|---|---|---|
| SCHEMBL8437040 | 0.70 | CACNA2D1 (0.43) | SIGMAR1 | |
| SCHEMBL24700015 | 0.69 | HDAC7 (0.31) | — | |
| SCHEMBL436979 | 0.67 | PLA2G1B (0.39) | SIGMAR1PLA2G1BPLA2G2A | |
| SCHEMBL2101698 | 0.65 | — | — | |
| SCHEMBL2162868 | 0.65 | — | — | |
| SCHEMBL9376579 | 0.65 | — | — | |
| SCHEMBL1446074 | 0.65 | SIGMAR1 (0.35) | SIGMAR1PLA2G1BPLA2G2A | |
| SCHEMBL11123620 | 0.65 | CYP2C19 (0.43) | — | |
| SCHEMBL7379244 | 0.65 | PLA2G1B (0.43) | SIGMAR1PLA2G1BPLA2G2A | |
| SCHEMBL5948831 | 0.65 | SIGMAR1 (0.35) | SIGMAR1PLA2G1BPLA2G2A |
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-5877227-A | POLYETHER ISOCYANATE PREPOLYMER FROM POLYMETHYLENEPOLYPHENYLENE POLYISOCYANATE AND DIPHENYLMETHANE DIISOCYANATE CONTAINING 2,4-ISOMERS, WATER AS SOLE FOAMING AGENT | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1999-03-02 | — | — | US | disclosed |
| WO-1999007760-A2 | LOW DENSITY FLEXIBLE POLYURETHANE FOAMS | HUNTSMAN ICI CHEMICALS LLC (US) | 1999-02-18 | — | — | WO | disclosed |