Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 3/20 | 0.59 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.59 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.54 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.46 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21068861 | 0.92 | CYP4F2 (0.60) | CYP4F2CYP4A11LOXL2SLC7A5MRGPRX4 | |
| SCHEMBL4876076 | 0.86 | MAOB (0.43) | CYP4F2CYP4A11SLC7A5MRGPRX4HPGD | |
| SCHEMBL4741394 | 0.86 | FOLH1 (0.46) | CYP4F2CYP4A11MRGPRX4FOLH1ALDH1A1 | |
| SCHEMBL8320447 | 0.86 | LOXL2 (0.56) | CYP4F2CYP4A11LOXL2SLC7A5MRGPRX4 | |
| SCHEMBL18579747 | 0.82 | CYP4F2 (0.43) | CYP4F2CYP4A11LOXL2TSHRALDH1A1 | |
| SCHEMBL7241207 | 0.81 | ATAD2 (0.41) | CYP4F2CYP4A11LOXL2SLC7A5ABHD6 | |
| SCHEMBL10145035 | 0.81 | MAPT (0.49) | MRGPRX4ALDH1A1NPC1KMT2ASMN1; SMN2 | |
| SCHEMBL15019978 | 0.80 | CYP4F2 (0.73) | CYP4F2CYP4A11LOXL2SLC7A5MRGPRX4 | |
| SCHEMBL31126580 | 0.80 | LOXL2 (0.43) | CYP4F2CYP4A11LOXL2SLC7A5MRGPRX4 | |
| SCHEMBL70173 | 0.80 | CYP4F2 (0.83) | CYP4F2CYP4A11LOXL2SLC7A5MRGPRX4 |
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-3901156-A1 | NITROOXYDERIVATIVE OF ROCK KINASE INHIBITOR | Vivavision (Shanghai) Ltd (CN) | 2021-10-27 | — | — | EP | disclosed |
| WO-2008096129-A1 | NITROGEN CONTAINING HETROCYCLIC COMPOUNDS USEFUL AS BIFUNCTIONAL MODULATORS OF M3 RECEPTORS AND BETA- 2 RECEPTORS | ARGENTA DISCOVERY LTD (GB) | 2008-08-14 | — | — | WO | disclosed |