Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | IDH2 | P48735 | 5/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13687259 | 0.90 | ATM (0.39) | ATMPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL13748086 | 0.83 | ATM (0.40) | ATMPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL13542942 | 0.82 | ATM (0.40) | ATMPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL3525958 | 0.82 | ATM (0.51) | ATMPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL13544674 | 0.76 | ATM (0.44) | ATMPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL13544479 | 0.74 | ATM (0.51) | ATMPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL13542943 | 0.72 | ATM (0.42) | ATMPOLBAPEX1KCNH2KMT2A | |
| SCHEMBL3524325 | 0.71 | ATM (0.57) | ATMPOLBAPEX1KMT2ALMNA | |
| SCHEMBL13545077 | 0.70 | ATM (0.43) | ATMPOLBAPEX1KCNH2KMT2A | |
| SCHEMBL3528864 | 0.69 | CA12 (0.55) | ATMPOLBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7589207-B2 | Cyclohexyl compounds as CCR5 antagonists | SMITHKLINE BEECHAM CORPORATION (US) | 2009-09-15 | — | — | US | disclosed |