Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.38 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 3/20 | 0.36 |
| ▸ | CNR2 | P34972 | 3/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19959671 | 0.83 | MAPT (0.43) | GSK3BMEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL8895206 | 0.78 | PDPK1 (0.43) | MEN1ALDH1A1MAPTKMT2A | |
| SCHEMBL23468143 | 0.75 | TNF (0.40) | TNFFFAR1GRM4GSK3BGPR139 | |
| SCHEMBL3937793 | 0.70 | FFAR1 (0.56) | TNFFFAR1GRM4GPR139KCNA5 | |
| SCHEMBL14762502 | 0.70 | GRM4 (0.48) | TNFFFAR1GRM4GSK3BGPR139 | |
| SCHEMBL1043636 | 0.69 | PDCD1 (0.51) | TNFFFAR1GRM4GSK3BGPR139 | |
| Benzonitrile SCHEMBL7358669 | 0.69 | FFAR1 (0.49) | TNFFFAR1GRM4GPR139MAPT | |
| SCHEMBL200244 | 0.68 | ERCC1 (0.52) | FFAR1GSK3BCNR1 | |
| SCHEMBL9646909 | 0.68 | LMNA (0.52) | TNFFFAR1GRM4GSK3BGPR139 | |
| SCHEMBL30860058 | 0.68 | ERCC1 (0.52) | FFAR1GSK3BCNR1 |
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-2018049296-A1 | HETEROARYL INHIBITORS OF PAD4 | PADLOCK THERAPEUTICS, INC. (US) | 2018-03-15 | — | — | WO | disclosed |