Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 5/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
| ▸ | DUT | P33316 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL9239998 | 0.88 | TACR1 (0.59) | TACR1TDP1KMT2ACCR5MEN1 | |
| SCHEMBL9114494 | 0.87 | TACR1 (0.64) | TACR1TDP1KMT2ACCR5MEN1 | |
| SCHEMBL9114531 | 0.80 | TACR1 (0.77) | TACR1TDP1KMT2ACCR5MEN1 | |
| SCHEMBL9112802 | 0.79 | TACR1 (0.61) | TACR1TDP1KMT2AMEN1NPC1 | |
| SCHEMBL9114442 | 0.76 | TACR1 (1.00) | TACR1TDP1KMT2ACCR5MEN1 | |
| SCHEMBL9114227 | 0.75 | TACR1 (0.61) | TACR1KMT2AMEN1GAARAB9A | |
| SCHEMBL9114068 | 0.75 | TACR1 (0.64) | TACR1TDP1KMT2AMEN1 | |
| SCHEMBL9114062 | 0.74 | TACR1 (0.62) | TACR1TDP1KMT2ACCR5MEN1 | |
| SCHEMBL9117035 | 0.73 | MTNR1A (0.65) | TACR1KMT2AMEN1GAAPOLB | |
| SCHEMBL7194988 | 0.73 | NPC1 (0.69) | TDP1KMT2AMEN1GAANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995011880-A1 | SUBSTITUTED AMIDES AS TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1995-05-04 | — | — | WO | disclosed |