Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL7580093 | 1.00 | CYP2A6 (0.36) | CYP2A6CA2L3MBTL1TDP1LMNA | |
| SCHEMBL7571246 | 0.82 | CYP1A2 (0.45) | CA2L3MBTL1LMNAMEN1KMT2A | |
| SCHEMBL7571250 | 0.82 | CYP1A2 (0.45) | CA2L3MBTL1LMNAMEN1KMT2A | |
| SCHEMBL7574040 | 0.77 | CA2 (0.32) | CA2L3MBTL1LMNAMEN1KMT2A | |
| SCHEMBL7574047 | 0.77 | CA2 (0.32) | CA2L3MBTL1LMNAMEN1KMT2A | |
| SCHEMBL7579473 | 0.75 | CA2 (0.31) | CA2L3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL7573202 | 0.75 | ALDH1A1 (0.32) | CA2L3MBTL1TDP1LMNAMEN1 | |
| SCHEMBL7572629 | 0.75 | CA2 (0.31) | CA2L3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL7572630 | 0.75 | CA2 (0.31) | CA2L3MBTL1LMNASMN1; SMN2 | |
| SCHEMBL7579481 | 0.75 | CA2 (0.31) | CA2L3MBTL1LMNASMN1; SMN2 |
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 |