Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 4/20 | 0.53 |
| ▸ | AAK1 | Q2M2I8 | 6/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.40 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 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 | |
|---|---|---|---|---|
| SCHEMBL8510729 | 0.82 | KMO (0.54) | KMOAAK1 | |
| SCHEMBL18179501 | 0.80 | KMO (0.42) | KMOAAK1PIK3CGMAPK8CAMKK2 | |
| SCHEMBL8514773 | 0.75 | ADRB1 (0.43) | KMOS1PR1PIK3CAKMT2ACLK4 | |
| SCHEMBL3397244 | 0.75 | MAP4K4 (0.52) | KMOAAK1PIK3CGPIK3CAPIK3CB | |
| Hydrochloric Acid SCHEMBL8514967 | 0.74 | ADRB1 (0.42) | KMOS1PR1KMT2ACLK4 | |
| SCHEMBL18036606 | 0.74 | KMO (0.67) | KMOAAK1S1PR1S1PR3 | |
| SCHEMBL12408680 | 0.74 | MEN1 (0.61) | KMOPIK3CGPIK3CAPIK3CBMEN1 | |
| SCHEMBL21508293 | 0.72 | AAK1 (0.42) | KMOAAK1S1PR1S1PR3DYRK1A | |
| SCHEMBL17744653 | 0.71 | KMO (0.51) | KMOAAK1PIK3CGS1PR1PIK3CA | |
| SCHEMBL1469470 | 0.71 | MAP4K4 (0.48) | KMOAAK1PIK3CGPIK3CAPIK3CB |
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-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | disclosed |