Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.47 |
| ▸ | CLK2 | P49760 | 2/20 | 0.47 |
| ▸ | CLK3 | P49761 | 2/20 | 0.47 |
| ▸ | NAMPT | P43490 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | WNT1 | P04628 | 3/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20172513 | 0.87 | MEN1 (0.54) | RAB9AMEN1KMT2ANPC1CYP11B1 | |
| SCHEMBL20172497 | 0.75 | TRPV1 (0.53) | RAB9ANPC1CYP11B1CYP11B2LMNA | |
| SCHEMBL20172511 | 0.75 | TRPV1 (0.53) | RAB9AALDH1A1NPC1CYP11B1CYP11B2 | |
| SCHEMBL20172440 | 0.74 | MEN1 (0.53) | ALDH1A1MEN1KMT2ACYP11B1CYP11B2 | |
| SCHEMBL20172448 | 0.74 | RAB9A (0.57) | RAB9AALDH1A1NPC1DYRK1ANAMPT | |
| SCHEMBL13647207 | 0.68 | LMNA (0.58) | RAB9AALDH1A1NPC1LMNATP53 | |
| SCHEMBL30844256 | 0.68 | LMNA (0.58) | RAB9AALDH1A1NPC1LMNATP53 | |
| SCHEMBL19111004 | 0.66 | EPHX2 (0.70) | ALDH1A1LMNAPKMSMN1; SMN2 | |
| SCHEMBL1911526 | 0.66 | HTT (0.67) | RAB9AALDH1A1KMT2ANPC1LMNA | |
| SCHEMBL20172442 | 0.65 | NAMPT (0.51) | ALDH1A1MEN1KMT2ACYP11B1CYP11B2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3137459-B1 | MORPHOLIN-PYRIDINE DERIVATIVES HAVING AFFINITY TO THE TAAR1 RECEPTOR | HOFFMANN LA ROCHE (CH) | 2018-05-23 | — | — | EP | disclosed |