Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.47 |
| ▸ | F9 | P00740 | 2/20 | 0.45 |
| ▸ | F10 | P00742 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA3 | P07451 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8613941 | 0.89 | ALOX5 (0.59) | ALOX5CYP3A4MAOBNPC1RAB9A | |
| SCHEMBL8615408 | 0.80 | ALOX5 (0.55) | ALOX5CYP3A4MAOBNPC1RAB9A | |
| SCHEMBL4506543 | 0.79 | CYP11B2 (0.68) | ALOX5CYP3A4CYP11B1CYP11B2MAPT | |
| SCHEMBL8618126 | 0.78 | MAOB (0.47) | ALOX5CYP3A4MAOBGSTP1MAOA | |
| SCHEMBL18297527 | 0.78 | MAOB (0.55) | ALOX5MAOBRAB9AMEN1KMT2A | |
| SCHEMBL8641406 | 0.78 | MAOB (0.57) | ALOX5MAOBRAB9AGSTP1F9 | |
| SCHEMBL29576561 | 0.77 | ALOX5 (0.73) | ALOX5CYP3A4MAOBNPC1RAB9A | |
| SCHEMBL2636350 | 0.77 | ALOX5 (0.73) | ALOX5CYP3A4MAOBNPC1RAB9A | |
| SCHEMBL27685147 | 0.77 | ALOX5 (0.68) | ALOX5CYP3A4NPC1RAB9AGSTP1 | |
| SCHEMBL8614216 | 0.76 | ERN1 (0.49) | GABRG2GABRB3GABRA5GABRA3MRGPRX4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0665836-B1 | BIFUNCTIONAL INTERMEDIATES FOR USE IN THE MANUFACTURE OF LIQUID CRYSTALS | HOECHST AG (DE) | 1998-04-29 | — | — | EP | disclosed |
| WO-1994010152-A1 | BIFUNCTIONAL INTERMEDIATES FOR USE IN THE MANUFACTURE OF LIQUID CRYSTALS | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-05-11 | — | — | WO | disclosed |