Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.75 |
| ▸ | RAB9A | P51151 | 2/20 | 0.75 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.62 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.61 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.61 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.61 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.61 |
| ▸ | CASP3 | P42574 | 1/20 | 0.60 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.60 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.60 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | KDM2B | Q8NHM5 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.57 |
| ▸ | MGLL | Q99685 | 1/20 | 0.57 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL4611341 | 1.00 | NPC1 (0.75) | NPC1RAB9APOLBMAPK1CHRM2 | |
| SCHEMBL9136904 | 0.98 | NPC1 (0.77) | NPC1RAB9APOLBMAPK1CHRM2 | |
| SCHEMBL3367257 | 0.95 | NPC1 (0.77) | NPC1RAB9APOLBMAPK1CHRM2 | |
| SCHEMBL5350428 | 0.91 | NPC1 (0.89) | NPC1RAB9APOLBMAPK1CHRM2 | |
| SCHEMBL1148371 | 0.91 | NPC1 (0.89) | NPC1RAB9APOLBMAPK1CHRM2 | |
| SCHEMBL5350433 | 0.91 | NPC1 (0.89) | NPC1RAB9APOLBMAPK1CHRM2 | |
| Bicarbonate SCHEMBL11475731 | 0.87 | NPC1 (0.83) | NPC1RAB9APOLBMAPK1CHRM2 | |
| SCHEMBL1036177 | 0.84 | MEN1 (0.61) | NPC1RAB9APOLBCHRM2CHRM4 | |
| SCHEMBL1039910 | 0.84 | MEN1 (0.61) | NPC1RAB9APOLBCHRM2CHRM4 | |
| SCHEMBL4675008 | 0.83 | NPC1 (0.71) | NPC1RAB9APOLBMAPK1CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5399698-A | Lipoxygenase inhibitor intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1995-03-21 | — | — | US | disclosed |
| US-5231103-A | Lipoxygenase inhibitors as antiinflammatory agents, antiasthma and cardiovascular disorders | BAYER AKTIENGESELLSCHAFT (DE) | 1993-07-27 | — | — | US | disclosed |
| EP-0525571-A1 | Quinolin-2-yl-methoxybenzylhydroxyureas as lipoxygenase inhibitors | BAYER AG (DE) | 1993-02-03 | — | — | EP | disclosed |