Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 20/20 | 0.81 |
| ▸ | TACR2 | P21452 | 3/20 | 0.80 |
| ▸ | TSHR | P16473 | 2/20 | 0.80 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.80 |
| ▸ | MEN1 | O00255 | 1/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.80 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.80 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.80 |
| ▸ | MTOR | P42345 | 1/20 | 0.80 |
| ▸ | BLM | P54132 | 1/20 | 0.80 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.80 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.80 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.80 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.80 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.80 |
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 | |
|---|---|---|---|---|
| SCHEMBL4463665 | 0.93 | TACR3 (0.83) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL4463672 | 0.93 | TACR3 (0.83) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL6448376 | 0.89 | TACR3 (1.00) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL4478086 | 0.89 | TACR3 (1.00) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL4478081 | 0.89 | TACR3 (1.00) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL6448375 | 0.89 | TACR3 (1.00) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL6450730 | 0.89 | TACR3 (0.81) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL6451638 | 0.89 | TACR3 (0.81) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL4459313 | 0.89 | TACR3 (1.00) | TACR3TACR2TSHRKDM4EMEN1 | |
| SCHEMBL4459316 | 0.89 | TACR3 (1.00) | TACR3TACR2TSHRKDM4EMEN1 |
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-0940391-B1 | Quinoline derivatives as tachykinin NK3 receptor antagonists | GLAXOSMITHKLINE SPA (IT) | 2004-08-18 | — | — | EP | claimed |