Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | BCL6 | P41182 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4805011 | 0.74 | LTA4H (0.79) | LTA4HCYP3A4CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL4670579 | 0.73 | BCDIN3D (0.55) | LTA4HRAB9APKMNPC1CFTR | |
| SCHEMBL13389708 | 0.73 | HTR2C (0.45) | LTA4HCYP3A4CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL18458974 | 0.72 | CHRNB2 (0.46) | HTR2CSMN1; SMN2 | |
| SCHEMBL4670501 | 0.72 | SMN1; SMN2 (0.45) | LTA4HCYP3A4CYP2D6CYP2C9RAB9A | |
| Hydrochloric Acid SCHEMBL4826139 | 0.72 | BCDIN3D (0.54) | LTA4HRAB9AHPGDMEN1KMT2A | |
| SCHEMBL15904401 | 0.71 | L3MBTL1 (0.63) | LTA4HCYP3A4CYP2D6CYP2C9CYP1A2 | |
| SCHEMBL8362789 | 0.71 | CHRNB2 (0.47) | CYP2D6CYP1A2RAB9APKMMEN1 | |
| SCHEMBL4669074 | 0.71 | RAB9A (0.46) | LTA4HRAB9ASMN1; SMN2HPGD | |
| SCHEMBL4669084 | 0.71 | RAB9A (0.46) | LTA4HRAB9ASMN1; SMN2HPGDALDH1A1 |
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-1757586-B1 | POLYSBUSTITUIRTE 1,1-PYRIDINYLAMINOCYCLOPROPANAMIN DERIVATE, VERFAHREN ZU DEREN HERSTELLUNG UND DIESE ENTHALTENDE PHARMATUETISCHE ZUSAMMENSETZUNG | SERVIER LAB (FR) | 2008-12-03 | — | — | EP | disclosed |
| EP-1757586-A1 | POLYSBUSTITUIRTE 1,1-PYRIDINYLAMINOCYCLOPROPANAMIN DERIVATE, VERFAHREN ZU DEREN HERSTELLUNG UND DIESE ENTHALTENDE PHARMATUETISCHE ZUSAMMENSETZUNG | Les Laboratoires Servier (FR) | 2007-02-28 | — | — | EP | disclosed |