Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.52 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.52 |
| ▸ | DPP4 | P27487 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | JAK1 | P23458 | 1/20 | 0.44 |
| ▸ | STS | P08842 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 3/20 | 0.43 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.43 |
| ▸ | KLK7 | P49862 | 2/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7860307 | 1.00 | NR1H2 (0.52) | NR1H2NR1H3DPP4HDAC1JAK2 | |
| SCHEMBL7860304 | 1.00 | NR1H2 (0.52) | NR1H2NR1H3DPP4HDAC1JAK2 | |
| SCHEMBL28334137 | 0.89 | NR1H2 (0.56) | NR1H2NR1H3DPP4HDAC1JAK2 | |
| SCHEMBL28334140 | 0.89 | NR1H2 (0.56) | NR1H2NR1H3DPP4HDAC1JAK2 | |
| SCHEMBL18589350 | 0.88 | ALDH1A1 (0.41) | NR1H2NR1H3STS | |
| SCHEMBL20628853 | 0.88 | ALDH1A1 (0.41) | NR1H2NR1H3STS | |
| SCHEMBL18609734 | 0.88 | ALDH1A1 (0.41) | NR1H2NR1H3STS | |
| SCHEMBL18607980 | 0.88 | ALDH1A1 (0.41) | NR1H2NR1H3STS | |
| SCHEMBL18608049 | 0.88 | ALDH1A1 (0.41) | NR1H2NR1H3STS | |
| SCHEMBL18589367 | 0.88 | ALDH1A1 (0.41) | NR1H2NR1H3STS |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5646144-A | FOR TREATING DISORDERS IN WHICH SUBSTANCE P PLAYS A PART IN DEVELOPMENT | CIBA-GEIGY CORPORATION (US) | 1997-07-08 | — | — | US | disclosed |
| US-5541195-A | SUBSTANCE P ANTAGONISTS | CIBA-GEIGY CORPORATION (US) | 1996-07-30 | — | — | US | disclosed |
| EP-0532456-B1 | 1-Acylpiperidine derivatives and their use as substance P antagonists | CIBA GEIGY AG (CH) | 1995-03-29 | — | — | EP | disclosed |
| US-5310743-A | Substance P antagonist | CIBA-GEIGY CORP. (US) | 1994-05-10 | — | — | US | disclosed |
| EP-0532456-A1 | 1-Acylpiperidine derivatives and their use as substance P antagonists | CIBA-GEIGY AG (CH) | 1993-03-17 | — | — | EP | disclosed |