Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 7/20 | 0.60 |
| ▸ | KDM5C | P41229 | 1/20 | 0.57 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.57 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 1/20 | 0.44 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.44 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | CHKA | P35790 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16795238 | 0.78 | LNPEP (0.47) | KDM5CKDM4CHRH4LNPEPMEN1 | |
| SCHEMBL13562439 | 0.77 | HRH4 (0.57) | HRH4ADRB2NCF1PLD1CHRNB2 | |
| SCHEMBL20803984 | 0.77 | CXCR4 (0.61) | CXCR4KDM5CKDM4CMEN1CHRM2 | |
| SCHEMBL15159867 | 0.75 | CXCR4 (1.00) | CXCR4KDM5CKDM4CMEN1CHRM2 | |
| SCHEMBL16795287 | 0.75 | HRH4 (0.65) | HRH4ADRB2NCF1PLD1HRH3 | |
| SCHEMBL28585221 | 0.74 | HRH4 (0.47) | CXCR4HRH4LNPEPMEN1KMT2A | |
| SCHEMBL16622435 | 0.73 | CXCR4 (0.60) | CXCR4KDM5CKDM4CHRH4PLD1 | |
| Water SCHEMBL28114124 | 0.73 | HRH4 (0.50) | CXCR4HRH4LNPEPCHKAELOVL1 | |
| SCHEMBL19996086 | 0.73 | HRH4 (0.50) | HRH4LNPEPMEN1KMT2ATDP1 | |
| Hydrochloric Acid SCHEMBL16612332 | 0.72 | CXCR4 (0.59) | CXCR4KDM5CKDM4CPLD1MEN1 |
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-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |