Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 4/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16138800 | 0.76 | ACHE (0.50) | ACHEALDH1A1HSD17B3SMN1; SMN2AKR1B1 | |
| SCHEMBL4889109 | 0.68 | ACHE (0.56) | ACHEALDH1A1CHRM2ADRA2ACYP2D6 | |
| SCHEMBL216973 | 0.68 | ACHE (0.56) | ACHEALDH1A1HSD17B3CHRM2ADRA2A | |
| SCHEMBL16865823 | 0.68 | ACHE (0.56) | ACHEALDH1A1CHRM2ADRA2ACYP2D6 | |
| SCHEMBL5845169 | 0.68 | ACHE (1.00) | ACHEALDH1A1AKR1B1KDM4EKMT2A | |
| SCHEMBL25385438 | 0.65 | ACHE (0.83) | ACHEALDH1A1LMNASMN1; SMN2AKR1B1 | |
| SCHEMBL10876362 | 0.64 | ALDH1A1 (0.70) | ACHEALDH1A1CHRM2ADRA2ACHRM1 | |
| SCHEMBL24157319 | 0.63 | ACHE (0.44) | ACHEALDH1A1HSD17B3CHRM2ADRA2A | |
| SCHEMBL19334727 | 0.63 | ACHE (0.48) | ACHEALDH1A1HSD17B3CHRM2ADRA2A | |
| SCHEMBL18873161 | 0.63 | ALDH1A1 (0.49) | ACHEALDH1A1HSD17B3CHRM2ADRA2A |
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-0273643-B1 | Conducting substituted polyisothianophthenes | UNIV CALIFORNIA (US) | 1994-01-26 | — | — | EP | disclosed |
| US-4795242-A | ELECTROCONDUCTIVITY | UNIVERSITY OF CALIFORNIA (US) | 1989-01-03 | — | — | US | disclosed |
| EP-0273643-A2 | Conducting substituted polyisothianophthenes | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1988-07-06 | — | — | EP | disclosed |