Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 2/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.40 |
| ▸ | G6PD | P11413 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL2016391 | 0.78 | GPR35 (0.56) | GPR35ALDH1A1CYP2C19 | |
| SCHEMBL4099366 | 0.77 | TDP1 (0.50) | PTPN1KMT2AALDH1A1L3MBTL1POLB | |
| SCHEMBL4101146 | 0.77 | PTPN1 (0.46) | PTPN1KMT2AALDH1A1HTTL3MBTL1 | |
| SCHEMBL8326737 | 0.77 | CYP4A11 (0.50) | GPR35PTPN1KMT2AALDH1A1HTT | |
| SCHEMBL8402772 | 0.75 | GPR35 (0.53) | GPR35KDM4E | |
| SCHEMBL10267923 | 0.75 | GPR35 (0.53) | GPR35PTPN1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL27864868 | 0.75 | GPR35 (0.53) | GPR35KMT2AALDH1A1L3MBTL1MEN1 | |
| SCHEMBL5595098 | 0.74 | GPR35 (0.60) | GPR35KMT2AALDH1A1POLBCYP2C19 | |
| SCHEMBL20495063 | 0.74 | MEN1 (0.59) | PTPN1KMT2AALDH1A1HTTL3MBTL1 | |
| SCHEMBL27648916 | 0.74 | GPR35 (0.55) | GPR35KMT2AALDH1A1HTTL3MBTL1 |
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-1879858-A2 | PROCESSES FOR PREPARING BIARYL UREAS AND ANALOGS THEREOF | Vertex Pharmaceuticals, Inc. (US) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006122072-A2 | PROCESSES FOR PREPARING BIARYL UREAS AND ANALOGS THEREOF | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-11-16 | — | — | WO | disclosed |