Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | CRHBP | P24387 | 1/20 | 0.52 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9112410 | 0.86 | TACR1 (0.70) | TACR1KDM4EATMMEN1KMT2A | |
| SCHEMBL9114531 | 0.83 | TACR1 (0.77) | TACR1MEN1KMT2ATDP1LTB4R | |
| SCHEMBL22022734 | 0.78 | CALM1 (0.47) | TACR1MEN1KMT2AALDH1A1LTB4R | |
| SCHEMBL9239998 | 0.76 | TACR1 (0.59) | TACR1MEN1KMT2ATDP1ALDH1A1 | |
| SCHEMBL9116053 | 0.75 | TACR1 (0.62) | TACR1MEN1KMT2ATDP1 | |
| SCHEMBL9113839 | 0.75 | CNR1 (0.62) | TACR1MEN1KMT2ATDP1ALDH1A1 | |
| SCHEMBL9495599 | 0.74 | KDM4E (0.67) | TACR1KDM4EATMMEN1KMT2A | |
| SCHEMBL9114062 | 0.73 | TACR1 (0.62) | TACR1MEN1KMT2ATDP1ALDH1A1 | |
| SCHEMBL9494093 | 0.72 | KDM4E (0.65) | TACR1KDM4EATMMEN1KMT2A | |
| SCHEMBL9114494 | 0.72 | TACR1 (0.64) | TACR1MEN1KMT2ATDP1LTB4R |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995011880-A1 | SUBSTITUTED AMIDES AS TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1995-05-04 | — | — | WO | claimed |
| WO-1995011880-A1 | SUBSTITUTED AMIDES AS TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1995-05-04 | — | — | WO | disclosed |