Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | NISCH | Q9Y2I1 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6135895 | 0.90 | NPC1 (0.33) | NPC1RAB9ASMN1; SMN2NOTUM | |
| SCHEMBL17512909 | 0.81 | USP1 (0.37) | NPC1RAB9ASMN1; SMN2GAANOTUM | |
| SCHEMBL8915564 | 0.81 | NOTUM (0.44) | NPC1RAB9ASMN1; SMN2HPGDGAA | |
| SCHEMBL135941 | 0.80 | SMN1; SMN2 (0.42) | NPC1RAB9ASMN1; SMN2HPGDGAA | |
| SCHEMBL15984285 | 0.76 | NISCH (0.44) | NOTUMNISCH | |
| SCHEMBL6699746 | 0.74 | NPC1 (0.35) | NPC1RAB9ASMN1; SMN2HPGDGAA | |
| SCHEMBL6699179 | 0.73 | TSHR (0.35) | — | |
| SCHEMBL834917 | 0.73 | NPC1 (0.36) | NPC1RAB9ASMN1; SMN2TP53NOTUM | |
| SCHEMBL343082 | 0.73 | DAPK3 (0.40) | NOTUMMAOBPTGS1 | |
| SCHEMBL5855957 | 0.72 | GSTP1 (0.46) | SMN1; SMN2HPGDALDH1A1TP53KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0367233-A2 | Process for the preparation of 2-(2-thienyl)-ethylamine and derivatives thereof | OCCIDENTAL CHEMICAL CORPORATION (US) | 1990-05-09 | — | — | EP | disclosed |
| US-4874876-A | ACYLATING THIOPHENE, REDUCING, HYDROLYZING | OCCIDENTAL CHEMICAL CORPORATION (US) | 1989-10-17 | — | — | US | disclosed |