Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.39 |
| ▸ | CDK1 | P06493 | 2/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CCNH | P51946 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 8/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | KHK | P50053 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16796145 | 0.73 | MKNK1 (0.51) | LRRK2MKNK1MKNK2MAPK8MAPK9 | |
| SCHEMBL5563952 | 0.72 | LRRK2 (0.42) | LRRK2MKNK1MKNK2MAPK8MAPK9 | |
| SCHEMBL2265125 | 0.71 | CDC7 (0.51) | MKNK1MKNK2MAPK8MAPK9MAPK10 | |
| SCHEMBL31020506 | 0.70 | IRAK4 (0.57) | LRRK2MKNK1MKNK2MAPK8MAPK9 | |
| SCHEMBL12075537 | 0.70 | IRAK4 (0.57) | LRRK2MKNK1MKNK2MAPK8MAPK9 | |
| SCHEMBL29005958 | 0.70 | RAB9A (0.54) | MAPK8MAPK9MAPK10KDM4EGAA | |
| SCHEMBL15824969 | 0.70 | HRH4 (0.46) | LRRK2MKNK1MKNK2MAPK8MAPK9 | |
| SCHEMBL17683140 | 0.69 | MKNK1 (0.51) | LRRK2MKNK1MKNK2MAPK8MAPK9 | |
| SCHEMBL30459875 | 0.69 | MKNK1 (0.51) | LRRK2MKNK1MKNK2MAPK8MAPK9 | |
| SCHEMBL12489602 | 0.69 | CDC7 (0.56) | LRRK2MKNK1MKNK2MAPK8MAPK9 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1117731-A | Heteroaromatic compounds with antipsychotic activity | WELLCOME FOUND (GB) | 1996-02-28 | — | — | CN | claimed |
| CN-102365280-A | Novel adenosine receptor ligands and uses thereof | DOMAIN THERAPEUTICS | 2012-02-29 | — | — | CN | disclosed |
| CN-102317273-A | (4-TERT-BUTYLPIPERAZIN-2-YL)(PIPERAZIN-1-YL)METHANONE-N-CARBOXAMIDE DERIVATIVES | ASTRAZENECA AB | 2012-01-11 | — | — | CN | disclosed |
| CN-102307857-A | High penetration compositions and their use | CHONGXI YU | 2012-01-04 | — | — | CN | disclosed |
| CN-101659658-A | Quinoline substituted by cyan | FOUNDER GROUP PKUCARE PHARMACE | 2010-03-03 | — | — | CN | disclosed |
| CN-101659657-A | Quinoline substituted by cyan and preparation method and applications thereof | FOUNDER GROUP PKUCARE PHARMACE | 2010-03-03 | — | — | CN | disclosed |
| US-6723735-B1 | TREATMENT OR PREVENTION OF ANXIETY | MERCK SHARP & DOHME LTD. | 2004-04-20 | — | — | US | disclosed |
| CN-1265098-A | Heterocyclic derivatives which inhibit factor XA | ZENECA LTD (GB) | 2000-08-30 | — | — | CN | disclosed |
| CN-1117731-A | Heteroaromatic compounds with antipsychotic activity | WELLCOME FOUND (GB) | 1996-02-28 | — | — | CN | disclosed |
| US-4331596-A | Arylazoarylazo-substituted azo, azomethine 1:2 chromium complex dyes | CIBA-GEIGY CORPORATION (US) | 1982-05-25 | — | — | US | disclosed |