Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1142882 | 0.84 | ERN1 (0.35) | CHRM2CHRM1GRM5FFAR1ERN1 | |
| SCHEMBL1142931 | 0.82 | KDM4E (0.39) | CHRM2CHRM1GRM5FFAR1ERN1 | |
| SCHEMBL1142800 | 0.79 | GRM5 (0.31) | CHRM2CHRM1GRM5FFAR1ERN1 | |
| SCHEMBL7571863 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL7573562 | 0.74 | KMT2A (0.32) | — | |
| SCHEMBL6202613 | 0.74 | CHRM2 (0.43) | CHRM2CHRM1GRM5FFAR1ERN1 | |
| SCHEMBL7573401 | 0.73 | PTGDR2 (0.36) | — | |
| SCHEMBL7581864 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL7228819 | 0.73 | CHRM2 (0.42) | CHRM2CHRM1GRM5FFAR1ERN1 | |
| SCHEMBL3452817 | 0.73 | CA12 (0.51) | ALDH1A1POLBCYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0810199-B1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL CO (JP) | 2002-09-25 | — | — | EP | disclosed |
| US-5756769-A | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0810199-A1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-12-03 | — | — | EP | disclosed |