Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.55 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.55 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7579687 | 1.00 | NPC1 (0.55) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL7572607 | 0.82 | CHRM5 (0.53) | NPC1CYP1A2SMN1; SMN2LMNARAB9A | |
| SCHEMBL7572612 | 0.82 | CHRM5 (0.53) | NPC1CYP1A2SMN1; SMN2LMNARAB9A | |
| SCHEMBL7572620 | 0.81 | NPC1 (0.56) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL7571728 | 0.80 | LMNA (0.43) | NPC1SMN1; SMN2LMNARAB9AHPGD | |
| SCHEMBL7571729 | 0.80 | LMNA (0.43) | NPC1SMN1; SMN2LMNARAB9AHPGD | |
| SCHEMBL7579180 | 0.80 | CHRM5 (0.58) | NPC1CYP1A2TDP1SMN1; SMN2RAB9A | |
| SCHEMBL7579172 | 0.80 | CHRM5 (0.58) | NPC1CYP1A2TDP1SMN1; SMN2RAB9A | |
| SCHEMBL7571775 | 0.79 | NPC1 (0.48) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL7571779 | 0.79 | NPC1 (0.48) | NPC1CASP3SENP8SENP7SENP6 |
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 |