Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 3/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.41 |
| ▸ | CDK1 | P06493 | 3/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | ITK | Q08881 | 7/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28102528 | 0.75 | DAO (0.42) | DAOATAD2GSK3BCCNB2CDK1 | |
| SCHEMBL1840159 | 0.75 | AURKA (0.57) | GSK3BITKMAPTNPC1HPGD | |
| SCHEMBL6489332 | 0.73 | CCNB2 (0.61) | DAOATAD2GSK3BCCNB2CDK1 | |
| SCHEMBL15279970 | 0.72 | GSK3B (0.68) | DAOATAD2GSK3BCCNB2CDK1 | |
| SCHEMBL22546457 | 0.72 | AXL (0.46) | DAOATAD2GSK3BCCNB2CDK1 | |
| SCHEMBL2289799 | 0.71 | DAO (0.47) | DAOATAD2GSK3BCCNB2CDK1 | |
| SCHEMBL18444860 | 0.70 | ITK (0.71) | CCNB2CDK1CCNB1CDK5CDK5R1 | |
| SCHEMBL6488203 | 0.70 | DAO (0.46) | DAOITKMAPTHPGDAURKA | |
| SCHEMBL5802435 | 0.70 | HRH4 (0.37) | GSK3BHRH4ITKHPGDAURKA | |
| SCHEMBL6488916 | 0.70 | DAO (0.46) | DAOHRH4ITKABL1SRC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017023993-A1 | 3-(1H-INDOL-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF | SAMUMED, LLC. (US) | 2017-02-09 | — | — | WO | disclosed |