Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KMO | O15229 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20339943 | 0.86 | NPBWR1 (0.40) | ALDH1A1APOBEC3GPOLBIKBKBPTGS2 | |
| SCHEMBL703287 | 0.84 | AHR (0.48) | ALDH1A1KMONPC1RAB9AKDM4E | |
| SCHEMBL5822962 | 0.84 | NOTUM (0.41) | ALDH1A1NPC1RAB9AMAPTMEN1 | |
| SCHEMBL13239549 | 0.80 | IKBKB (0.33) | IKBKB | |
| SCHEMBL25065199 | 0.79 | PIK3CD (0.40) | ALDH1A1CYP3A4KDM4ENPSR1MAPT | |
| SCHEMBL22878421 | 0.79 | NISCH (0.44) | KMOPTGS2MAPT | |
| SCHEMBL23291740 | 0.79 | KDM4E (0.33) | KDM4EMAPT | |
| SCHEMBL4399156 | 0.79 | ALDH1A1 (0.52) | ALDH1A1CYP3A4NPC1RAB9AKDM4E | |
| SCHEMBL8217792 | 0.79 | ESR2 (0.46) | PTGS2TSHRHSD17B10 | |
| SCHEMBL6621917 | 0.79 | NPC1 (0.35) | NPC1RAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6787556-B1 | PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR (PPAR) AGONISTS; type 2 gamma receptors; INSULIN RESISTANCE; carboxybenzyl group on a phenyl-substituted tetrazole, pyrazole, or imidazole ring | ASTRAZENECA AB (SE) | 2004-09-07 | — | — | US | disclosed |
| EP-1210339-A1 | BENZOIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETES MELLITUS | AstraZeneca AB (SE) | 2002-06-05 | — | — | EP | disclosed |
| EP-1150972-A1 | TRIAZOLE AND TETRAZOLE DERIVATIVES, AND THEIR THERAPEUTIC USE | SANOFI-SYNTHELABO (FR) | 2001-11-07 | — | — | EP | disclosed |
| WO-2001012612-A1 | BENZOIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETES MELLITUS | ASTRAZENECA AB (SE) | 2001-02-22 | — | — | WO | disclosed |
| WO-2000046220-A1 | TRIAZOLE AND TETRAZOLE DERIVATIVES, AND THEIR THERAPEUTIC USE | SANOFI-SYNTHELABO (FR) | 2000-08-10 | — | — | WO | disclosed |