Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 9/20 | 0.71 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8459967 | 0.92 | TACR1 (0.59) | TACR1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL8947995 | 0.89 | TACR1 (0.56) | TACR1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL8936513 | 0.83 | TACR1 (1.00) | TACR1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL8936439 | 0.80 | TACR1 (0.86) | TACR1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL8948077 | 0.78 | DPP4 (0.55) | TACR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL8948063 | 0.78 | TACR1 (0.48) | TACR1SMN1; SMN2 | |
| SCHEMBL8947972 | 0.78 | DPP4 (0.54) | TACR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL8947979 | 0.78 | DPP4 (0.54) | TACR1NPC1RAB9AMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8948118 | 0.77 | TACR1 (0.50) | TACR1 | |
| SCHEMBL8947984 | 0.77 | DPP4 (0.53) | TACR1NPC1RAB9AMEN1KMT2A |
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-5527811-A | CALCIUM- AND SUBSTANCE P RECEPTOR-ANTAGONIST ACTIVITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-06-18 | — | — | US | disclosed |
| EP-0634402-A1 | Isochinolinone derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1995-01-18 | — | — | EP | disclosed |