Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.58 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.57 |
| ▸ | GRM5 | P41594 | 1/20 | 0.53 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | IKBKB | O14920 | 2/20 | 0.47 |
| ▸ | CHUK | O15111 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9142579 | 0.85 | KEAP1 (0.69) | KEAP1PDPK1GRM5AHRIKBKB | |
| SCHEMBL9141346 | 0.84 | KEAP1 (0.58) | KEAP1PDPK1GRM5AHRMEN1 | |
| SCHEMBL27580164 | 0.84 | KEAP1 (0.58) | KEAP1PDPK1GRM5AHRMEN1 | |
| Methylene Chloride SCHEMBL11485680 | 0.83 | KEAP1 (0.61) | KEAP1PDPK1GRM5AHRIKBKB | |
| SCHEMBL9142182 | 0.81 | KEAP1 (0.54) | KEAP1PDPK1GRM5MEN1NPC1 | |
| SCHEMBL27967849 | 0.76 | KEAP1 (0.70) | KEAP1PDPK1GRM5AHRIKBKB | |
| SCHEMBL30690400 | 0.76 | KEAP1 (0.70) | KEAP1PDPK1GRM5AHRIKBKB | |
| SCHEMBL3790885 | 0.76 | KEAP1 (0.70) | KEAP1PDPK1GRM5AHRIKBKB | |
| SCHEMBL27968063 | 0.76 | KEAP1 (0.70) | KEAP1PDPK1GRM5AHRIKBKB | |
| SCHEMBL28213845 | 0.76 | KEAP1 (0.55) | KEAP1PDPK1GRM5MEN1NPC1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5446162-A | Process for the production of 7-acylindoles | LONAZ LTD. (CH) | 1995-08-29 | — | — | US | disclosed |
| US-5380857-A | Process for the production of 7-acylindoles | LONZA LTD. (CH) | 1995-01-10 | — | — | US | disclosed |
| EP-0258048-B1 | 2-AMINO-3-AROYL-GAMMA-OXOBENZENEBUTANOIC ACIDS AND ESTERS | A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) | 1992-03-25 | — | — | EP | disclosed |
| US-4855447-A | ANTIINFLAMMATORY, 7-AROYL-1H-INDOLE-3-PROPANOIC OR PROPANEDIOIC ACID INTERMEDIATES | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-08-08 | — | — | US | disclosed |
| US-4855448-A | ANTIINFLAMMATORY AGENTS | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-08-08 | — | — | US | disclosed |
| US-4782089-A | ANTIINFLAMMATORY, ANALGESIC | A. H. ROBINS COMPANY, INCORPORATED (US) | 1988-11-01 | — | — | US | disclosed |
| EP-0258048-A2 | 2-Amino-3-aroyl-gamma-oxobenzenebutanoic acids and esters | A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) | 1988-03-02 | — | — | EP | disclosed |