Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR17 | Q13304 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | HPGD | P15428 | 5/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 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 | |
|---|---|---|---|---|
| SCHEMBL9189032 | 0.83 | GPR17 (0.59) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL1144751 | 0.80 | GPR17 (0.64) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30779683 | 0.79 | GPR17 (0.63) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL8692433 | 0.78 | KDM4E (0.59) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4877546 | 0.76 | GPR17 (0.60) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL29956530 | 0.75 | GPR17 (0.59) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL20535956 | 0.74 | KDM4E (0.60) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9672508 | 0.74 | KDM4E (0.57) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL7501990 | 0.73 | ALDH1A1 (0.65) | GPR17KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4878704 | 0.72 | GPR17 (0.49) | GPR17KDM4EALDH1A1HPGDHSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103130705-B | Benzo five-membered unsaturated heterocycle compound or its pharmaceutical salts and preparation method thereof, pharmaceutical composition and application thereof | INSTITUTE OF MEDICINAL BIOTECHNOLOGY, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2016-04-20 | — | — | CN | disclosed |