Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.49 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | VDR | P11473 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7976022 | 0.91 | GPR35 (0.57) | GPR35KMT2AALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL9364666 | 0.85 | AKR1B1 (0.53) | KMT2AALDH1A1CYP1A2CYP2C19MEN1 | |
| SCHEMBL8139487 | 0.84 | ALDH1A1 (0.58) | GPR35KMT2AALDH1A1MAPTAKR1B1 | |
| SCHEMBL9365478 | 0.84 | MAPT (0.67) | GPR35KMT2AALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL10432084 | 0.83 | AKR1B1 (0.45) | GPR35KMT2AALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL9093727 | 0.81 | L3MBTL1 (0.61) | GPR35KMT2AALDH1A1MAPTAKR1B1 | |
| SCHEMBL9365437 | 0.81 | GPR35 (0.64) | GPR35KMT2AALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL5973284 | 0.81 | GPR35 (0.67) | GPR35KMT2AALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL9364718 | 0.81 | SMN1; SMN2 (0.67) | KMT2AALDH1A1CYP2C19MEN1MAPT | |
| SCHEMBL9705730 | 0.80 | KMT2A (0.50) | GPR35KMT2AALDH1A1CYP1A2CYP2C19 |
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-0377112-B1 | Quinoxaline compounds and their preparation and use | NOVO NORDISK AS (DK) | 1994-08-24 | — | — | EP | disclosed |
| US-5061706-A | 2,3-QUINOXALINEDIONES FOR USE AS NEUROLEPTICS | NOVO NORDISK A/S (DK) | 1991-10-29 | — | — | US | disclosed |
| EP-0377112-A1 | Quinoxaline compounds and their preparation and use | NOVO NORDISK A/S (DK) | 1990-07-11 | — | — | EP | disclosed |