Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 3/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | BCHE | P06276 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | ALPL | P05186 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | CCR3 | P51677 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9114227 | 0.86 | TACR1 (0.61) | TACR1MEN1KMT2ABCHEMTNR1A | |
| SCHEMBL9116017 | 0.86 | MEN1 (0.68) | TACR1L3MBTL1MEN1KMT2AMTNR1A | |
| SCHEMBL9115325 | 0.80 | MEN1 (0.75) | TACR1MEN1KMT2ANPC1ALDH1A1 | |
| SCHEMBL8356709 | 0.79 | TACR1 (0.55) | TACR1MEN1KMT2ABCHELMNA | |
| SCHEMBL9114494 | 0.74 | TACR1 (0.64) | TACR1L3MBTL1MEN1KMT2ASIGMAR1 | |
| SCHEMBL9117035 | 0.74 | MTNR1A (0.65) | TACR1MEN1KMT2AMTNR1AMTNR1B | |
| SCHEMBL9468387 | 0.74 | NPC1 (0.60) | NPC1CNR2ALDH1A1MAPTHTT | |
| SCHEMBL9113000 | 0.73 | TACR1 (0.69) | TACR1MEN1KMT2AMTNR1AMTNR1B | |
| SCHEMBL30468424 | 0.72 | CA1 (0.54) | MTNR1AMTNR1BALDH1A1MAPTHTT | |
| SCHEMBL228947 | 0.72 | CA1 (0.54) | MTNR1AMTNR1BALDH1A1MAPTHTT |
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 |