Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | CTSD | P07339 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12205524 | 0.83 | RAB9A (0.52) | RAB9AMEN1KMT2ANPC1TP53 | |
| SCHEMBL1643645 | 0.82 | LMNA (0.46) | RAB9AMEN1KMT2ANPC1TP53 | |
| SCHEMBL10899012 | 0.81 | RAB9A (0.56) | RAB9AMEN1KMT2ANPC1TP53 | |
| SCHEMBL322168 | 0.81 | CTSD (0.62) | RAB9ANPC1SMN1; SMN2CNR2CTSD | |
| SCHEMBL29658169 | 0.81 | CTSD (0.62) | RAB9ANPC1SMN1; SMN2CNR2CTSD | |
| SCHEMBL27789892 | 0.79 | CTSD (0.60) | RAB9ANPC1SMN1; SMN2CNR2CTSD | |
| SCHEMBL4706785 | 0.79 | CTNNB1 (0.46) | RAB9AKMT2ANPC1TP53SMN1; SMN2 | |
| SCHEMBL9575507 | 0.78 | CTSD (0.51) | RAB9ANPC1GAASMN1; SMN2CNR2 | |
| SCHEMBL7496703 | 0.78 | RAB9A (0.51) | RAB9AMEN1KMT2ANPC1TP53 | |
| SCHEMBL30118936 | 0.78 | RAB9A (0.71) | RAB9AMEN1KMT2ANPC1TP53 |
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-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |
| CN-1646502-A | Triazole derivatives as tachykinin receptor antagonists | LILLY CO ELI (US) | 2005-07-27 | — | — | CN | disclosed |