Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | GRK6 | P43250 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | FABP3 | P05413 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL10892974 | 0.91 | NPSR1 (0.43) | NPSR1CYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL9306232 | 0.78 | DAGLA (0.41) | NPSR1HPGDGRK6ALDH1A1NPC1 | |
| SCHEMBL9304109 | 0.78 | RAB9A (0.34) | NPSR1HPGDALDH1A1MAPTNPC1 | |
| SCHEMBL9305335 | 0.77 | TOP2A (0.38) | NPSR1GAAHPGDALDH1A1NPC1 | |
| SCHEMBL8973084 | 0.77 | SOAT1 (0.37) | — | |
| SCHEMBL9305152 | 0.75 | NPSR1 (0.38) | NPSR1GAACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10892693 | 0.74 | NPSR1 (0.46) | NPSR1GAACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9305134 | 0.74 | NPSR1 (0.39) | NPSR1GAACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8972330 | 0.73 | KMT2A (0.52) | CYP1A2CYP3A4CYP2C9CYP2C19HPGD | |
| SCHEMBL9306346 | 0.72 | CYP1A2 (0.36) | GAACYP1A2CYP3A4CYP2C9CYP2C19 |
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-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| US-5152929-A | Corrosion inhibitors for water systems | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |