Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 7/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9727341 | 0.89 | EGFR (0.42) | EGFRERBB2CNR2TDP1ESR1 | |
| SCHEMBL14240058 | 0.82 | EGFR (0.45) | EGFRERBB2CNR2TDP1ESR1 | |
| SCHEMBL11769284 | 0.82 | ALDH1A1 (0.45) | CNR2MAPTALDH1A1MEN1GAA | |
| SCHEMBL3223255 | 0.81 | ALDH1A1 (0.55) | CNR2TDP1MAPTALDH1A1MEN1 | |
| SCHEMBL768272 | 0.80 | EGFR (0.47) | EGFRERBB2CNR2TDP1AR | |
| SCHEMBL17663681 | 0.80 | EGFR (0.47) | EGFRERBB2CNR2TDP1AR | |
| SCHEMBL2014159 | 0.80 | EGFR (0.47) | EGFRERBB2CNR2TDP1AR | |
| SCHEMBL7153351 | 0.80 | EGFR (0.50) | EGFRERBB2CNR2TDP1AR | |
| SCHEMBL3225090 | 0.79 | CNR2 (0.48) | EGFRERBB2CNR2TDP1MAPT | |
| SCHEMBL4861650 | 0.78 | CNR2 (0.50) | EGFRERBB2CNR2TDP1ESR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5164514-A | Antispasmodics | ROUSSEL UCLAF (FR) | 1992-11-17 | — | — | US | disclosed |
| US-5081130-A | Antispasmodic agents | ROUSSEL UCLAF (FR) | 1992-01-14 | — | — | US | disclosed |
| US-4990531-A | Antispasmodic agents | ROUSSEL UCLAF (FR) | 1991-02-05 | — | — | US | disclosed |