Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 6/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8947989 | 0.91 | THRB (0.51) | THRBTACR1POLB | |
| SCHEMBL9177097 | 0.85 | TACR1 (0.48) | DPP4TACR1POLB | |
| SCHEMBL8947970 | 0.84 | DPP4 (0.57) | DPP4TACR1KDM4E | |
| SCHEMBL8947956 | 0.84 | DPP4 (0.56) | DPP4TACR1KDM4E | |
| SCHEMBL8947947 | 0.84 | DPP4 (0.56) | DPP4TACR1KDM4E | |
| SCHEMBL8947953 | 0.82 | DPP4 (0.54) | DPP4TACR1 | |
| SCHEMBL8947680 | 0.81 | DPP4 (0.53) | DPP4TACR1 | |
| SCHEMBL5237229 | 0.81 | DPP4 (0.56) | DPP4TACR1 | |
| SCHEMBL8947848 | 0.81 | DPP4 (0.57) | DPP4TACR1 | |
| SCHEMBL8947904 | 0.80 | DPP4 (0.52) | DPP4THRBTACR1KDM4ELMNA |
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 |