Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.62 |
| ▸ | HTR1A | P08908 | 2/20 | 0.62 |
| ▸ | HTR2B | P41595 | 2/20 | 0.62 |
| ▸ | FAAH | O00519 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | MC4R | P32245 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL24514671 | 0.89 | NPC1 (0.71) | DRD2HTR1AHTR2BFAAHNPC1 | |
| SCHEMBL22793926 | 0.89 | NPC1 (0.71) | DRD2HTR1AHTR2BFAAHNPC1 | |
| SCHEMBL25108942 | 0.89 | NPC1 (0.71) | DRD2HTR1AHTR2BFAAHNPC1 | |
| Ammonia Solution, Strong SCHEMBL10669228 | 0.89 | KDM4E (0.63) | DRD2HTR1AHTR2BFAAHSIGMAR1 | |
| Ammonia Solution, Strong SCHEMBL10666871 | 0.87 | KDM4E (0.62) | DRD2HTR1AHTR2BFAAHALDH1A1 | |
| SCHEMBL10682807 | 0.86 | KDM4E (0.63) | DRD2HTR1AHTR2BFAAHALDH1A1 | |
| SCHEMBL11041528 | 0.85 | SIGMAR1 (0.52) | DRD2HTR1AHTR2BNPC1TP53 | |
| SCHEMBL8799177 | 0.85 | SIGMAR1 (0.52) | DRD2HTR1AHTR2BNPC1TP53 | |
| SCHEMBL14076364 | 0.81 | SIGMAR1 (0.79) | DRD2HTR1AHTR2BSIGMAR1ALDH1A1 | |
| SCHEMBL25481377 | 0.81 | NPC1 (0.53) | DRD2HTR1AHTR2BFAAHNPC1 |
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-0040696-B1 | AMINOTHIADIAZOLES AS GASTRIC SECRETION INHIBITORS | MERCK & CO. INC. (US) | 1986-08-27 | — | — | EP | disclosed |
| EP-0040696-A2 | Aminothiadiazoles as gastric secretion inhibitors | MERCK & CO. INC. (US) | 1981-12-02 | — | — | EP | disclosed |