Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.62 |
| ▸ | CHKA | P35790 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 7/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | SNCA | P37840 | 7/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | CASP1 | P29466 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | HBB | P68871 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ADK | P55263 | 3/20 | 0.45 |
| ▸ | APP | P05067 | 4/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10300053 | 0.86 | ALDH1A1 (0.65) | MAPTSNCAALOX15ALDH1A1TSHR | |
| SCHEMBL770159 | 0.86 | ALDH1A1 (0.65) | MAPTSNCAALOX15ALDH1A1TSHR | |
| SCHEMBL1649302 | 0.81 | HDAC8 (0.55) | MAPTAPPGRM5 | |
| SCHEMBL9131675 | 0.79 | CHRM5 (0.47) | CHRM5CHKAMAPTSMN1; SMN2SNCA | |
| SCHEMBL189 | 0.78 | — | — | |
| SCHEMBL8664726 | 0.78 | CHRM5 (1.00) | CHRM5CHKAMAPTSMN1; SMN2ALOX15 | |
| SCHEMBL1820120 | 0.78 | HDAC8 (0.58) | MAPTSMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL9073927 | 0.77 | APP (0.68) | CHRM5CHKAMAPTSMN1; SMN2SNCA | |
| SCHEMBL2555531 | 0.77 | APP (0.57) | MAPTSNCAALOX15MEN1NPC1 | |
| SCHEMBL711868 | 0.77 | ALDH1A1 (0.46) | MAPTSNCAALOX15ALDH1A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0290591-B1 | MATERIALS WITH NITROGENOUS SIX-MEMBERED RINGS | MERCK PATENT GmbH (DE) | 1991-03-13 | — | — | EP | disclosed |
| EP-0290591-A1 | MATERIALS WITH NITROGENOUS SIX-MEMBERED RINGS. | MERCK PATENT GMBH (DE) | 1988-11-17 | — | — | EP | disclosed |
| WO-1988004305-A1 | MATERIALS WITH NITROGENOUS SIX-MEMBERED RINGS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1988-06-16 | — | — | WO | disclosed |