Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 6/20 | 0.43 |
| ▸ | CDK8 | P49336 | 6/20 | 0.43 |
| ▸ | CDK19 | Q9BWU1 | 2/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Propylformate SCHEMBL28127351 | 0.89 | CCNC (0.39) | CCNCCDK8CDK19PDE3BPDE3A | |
| Ethoxycarbonyl Group SCHEMBL27647387 | 0.88 | CCNC (0.43) | CCNCCDK8CDK19CYP2A6CYP17A1 | |
| Formic Acid Methyl Ester SCHEMBL28127394 | 0.84 | PDE3B (0.42) | CCNCCDK8CDK19PDE3BPDE3A | |
| Tert-Butyl Formate SCHEMBL27572989 | 0.81 | TDP1 (0.39) | CCNCCDK8CDK19PDE3BPDE3A | |
| Ethoxycarbonyl Group SCHEMBL28014965 | 0.80 | CYP17A1 (0.58) | CCNCCDK8CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL28127352 | 0.79 | PDE3B (0.38) | CCNCCDK8CDK19PDE3BPDE3A | |
| Ethoxycarbonyl Group SCHEMBL28767000 | 0.79 | CCNC (0.49) | CCNCCDK8CDK19CYP2A6CYP17A1 | |
| SCHEMBL30205720 | 0.79 | — | — | |
| SCHEMBL67000 | 0.79 | — | — | |
| SCHEMBL709416 | 0.79 | PDE3B (0.50) | CCNCCDK8PDE3BPDE3ACYP2A6 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103517903-B | Pyrrolopyridine aminoderivative as MPS1 inhibitor | 癌症研究科技有限公司 | 2017-03-01 | — | — | CN | claimed |
| CN-103517903-B | Pyrrolopyridine aminoderivative as MPS1 inhibitor | 癌症研究科技有限公司 | 2017-03-01 | — | — | CN | disclosed |
| CN-100480249-C | Pyrrolopyridine-2-carboxylic acid amides as glycogen phosphorylase inhibitors | PROSIDION LTD (GB) | 2009-04-22 | — | — | CN | disclosed |
| CN-100439367-C | Substituted 1H-pyrrolo[3,2-b, 3,2-c, and 2,3-c]pyridine-2-carboxamides and related analogs as inhibitors of casein kinase lepsilon | AVENTIS PHARMA INC (US) | 2008-12-03 | — | — | CN | disclosed |
| CN-1906194-A | Substituted 1H-pyrrolo [3, 2-b, 3, 2-c and 2, 3-c ] pyridine-2-carboxamides and related analogs as inhibitors of casein kinase ie | AVENTIS PHARMA INC (US) | 2007-01-31 | — | — | CN | disclosed |
| CN-1826340-A | Pyrrolopyridine-2-carboxylic acid amides as glycogen phosphorylase inhibitors | PROSIDION LTD (GB) | 2006-08-30 | — | — | CN | disclosed |