Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.46 |
| ▸ | WNT3A | P56704 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 2/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.41 |
| ▸ | ALPL | P05186 | 1/20 | 0.41 |
| ▸ | XIAP | P98170 | 1/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4705926 | 0.79 | CES2 (0.47) | CTNNB1WNT3AL3MBTL1KMT2ANPC1 | |
| SCHEMBL29896666 | 0.79 | CES2 (0.47) | CTNNB1WNT3AL3MBTL1KMT2ANPC1 | |
| SCHEMBL2901555 | 0.79 | RORB (0.55) | KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL29387256 | 0.79 | CYP3A4 (0.55) | KMT2ATP53SMN1; SMN2ALDH1A1ENPP3 | |
| SCHEMBL333141 | 0.79 | CYP3A4 (0.55) | KMT2ATP53SMN1; SMN2ALDH1A1ENPP3 | |
| SCHEMBL4707136 | 0.79 | RAB9A (0.51) | KMT2ANPC1RAB9ATP53KDM4E | |
| SCHEMBL4707275 | 0.79 | AKR1C3 (0.52) | L3MBTL1KMT2ANPC1RAB9AKDM4E | |
| SCHEMBL7851627 | 0.78 | KDM4E (0.62) | CTNNB1WNT3AL3MBTL1KMT2AMYC | |
| SCHEMBL8764829 | 0.77 | CTNNB1 (0.44) | CTNNB1WNT3AL3MBTL1KMT2ANPC1 | |
| SCHEMBL8691222 | 0.77 | L3MBTL1 (0.54) | CTNNB1WNT3AL3MBTL1KMT2ANPC1 |
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 3 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-1312136-C | Triazole derivatives as tachykinin receptor antagonists | LILLY CO ELI (US) | 2007-04-25 | — | — | CN | disclosed |
| CN-1646502-A | Triazole derivatives as tachykinin receptor antagonists | LILLY CO ELI (US) | 2005-07-27 | — | — | CN | disclosed |