Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.81 |
| ▸ | LMNA | P02545 | 3/20 | 0.71 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 1/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | FLT1 | P17948 | 1/20 | 0.50 |
| ▸ | FLT4 | P35916 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11474969 | 0.90 | CYP2C19 (1.00) | CYP2C19LMNANPC1RAB9AHPGD | |
| Hydrochloric Acid SCHEMBL11489984 | 0.89 | CYP2C19 (0.98) | CYP2C19LMNANPC1RAB9AHPGD | |
| Hydrochloric Acid SCHEMBL11551503 | 0.86 | CYP2C19 (0.62) | CYP2C19LMNANPC1RAB9AHPGD | |
| SCHEMBL8771387 | 0.80 | ALDH1A1 (0.61) | CYP2C19ALDH1A1SMN1; SMN2EPHX2 | |
| SCHEMBL4542164 | 0.79 | SMN1; SMN2 (0.64) | CYP2C19LMNARAB9AMEN1KMT2A | |
| SCHEMBL6706763 | 0.78 | MCHR1 (0.72) | CYP2C19LMNANPC1RAB9AHPGD | |
| SCHEMBL11719750 | 0.78 | CYP2C19 (0.60) | CYP2C19LMNACYP1A2CYP3A4MEN1 | |
| SCHEMBL6706726 | 0.77 | MCHR1 (0.71) | CYP2C19LMNANPC1RAB9AHPGD | |
| SCHEMBL11554301 | 0.77 | NPC1 (0.65) | CYP2C19LMNANPC1RAB9AHPGD | |
| SCHEMBL9410255 | 0.76 | ALDH1A1 (0.59) | CYP2C19CYP1A2CYP3A4MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4152518-A | ANTIINFLAMMATORY AGENTS | STERLING DRUG INC. (US) | 1979-05-01 | — | — | US | disclosed |
| US-4112105-A | Anti-inflammatory 3-(substituted-amino)-2,1-benzisothiazoles | STERLING DRUG INC. (US) | 1978-09-05 | — | — | US | disclosed |