Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1128140 | 0.98 | PSMB5 (0.47) | PSMB5PTGDR2ALDH1A1MEN1HPGD | |
| SCHEMBL15567031 | 0.91 | CHRNB2 (0.44) | ALDH1A1MEN1HPGDALOX15ALOX12 | |
| SCHEMBL19308494 | 0.83 | PTGDR2 (0.47) | PSMB5PTGDR2ALDH1A1CHRNB2CHRNA4 | |
| SCHEMBL5543574 | 0.82 | GRM7 (0.39) | PSMB5PTGDR2ALDH1A1MEN1HPGD | |
| SCHEMBL14370206 | 0.82 | ALDH1A1 (0.39) | ALDH1A1MEN1HPGDALOX15ALOX12 | |
| SCHEMBL5534626 | 0.82 | HTR2C (0.61) | CHRNB2CHRNA4HTR2C | |
| SCHEMBL7422191 | 0.81 | PTGDR2 (0.50) | PSMB5PTGDR2ALDH1A1MEN1KMT2A | |
| SCHEMBL17642598 | 0.80 | QDPR (0.42) | ALDH1A1MEN1KMT2AHTR2C | |
| SCHEMBL14370207 | 0.80 | GRM7 (0.44) | PTGDR2CHRNB2CHRNA4GRM7NOTUM | |
| Hydrochloric Acid SCHEMBL29688771 | 0.80 | HTR2C (0.62) | MEN1KMT2ACHRNB2CHRNA4HTR2C |
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-4316034-A | ISOCYANATE PRECURSOR | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1982-02-16 | — | — | US | claimed |