Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 6/20 | 0.38 |
| ▸ | ULK1 | O75385 | 2/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | PTPRB | P23467 | 1/20 | 0.37 |
| ▸ | PTPRE | P23469 | 1/20 | 0.37 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5495158 | 0.86 | GPR84 (0.46) | GPR84KIF11AHRULK1PTPRC | |
| SCHEMBL28777719 | 0.80 | GPR84 (0.54) | GPR84KIF11POLBAHRESR1 | |
| SCHEMBL5495155 | 0.77 | GPR84 (0.47) | GPR84KIF11AHRULK1ESR1 | |
| SCHEMBL395515 | 0.77 | GPR84 (0.47) | GPR84KIF11AHRULK1ESR1 | |
| SCHEMBL5236426 | 0.75 | GPR84 (0.64) | GPR84KIF11POLBAHRULK1 | |
| SCHEMBL12288155 | 0.74 | GPR84 (0.47) | GPR84KIF11POLBAHRULK1 | |
| SCHEMBL2272066 | 0.74 | CSNK2A1 (0.55) | GPR84KIF11AHRESR1CTNNB1 | |
| SCHEMBL8957501 | 0.72 | GPR84 (0.46) | GPR84KIF11POLBAHRULK1 | |
| SCHEMBL17703916 | 0.72 | GPR84 (0.64) | GPR84KIF11POLBAHRULK1 | |
| SCHEMBL850198 | 0.70 | CSNK2A1 (0.55) | GPR84KIF11POLBAHRULK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2007756-B1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMA (US) | 2015-08-26 | — | — | EP | disclosed |
| WO-2007117715-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-10-18 | — | — | WO | disclosed |