Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 13/20 | 0.37 |
| ▸ | AGXT | P21549 | 7/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ABAT | P80404 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.34 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17264302 | 0.88 | IDO1 (0.50) | CHRNB2CHRNA4IDO1AGXTCA2 | |
| SCHEMBL2557127 | 0.78 | EPHX1 (0.45) | CHRNB2CHRNA4IDO1AGXTSLC1A3 | |
| SCHEMBL11197240 | 0.77 | SLC1A3 (0.46) | CHRNB2CHRNA4IDO1AGXTCA2 | |
| SCHEMBL24566617 | 0.74 | CHRNB2 (0.41) | CHRNB2CHRNA4IDO1AGXTCA2 | |
| SCHEMBL9188228 | 0.74 | IDO1 (0.36) | CHRNB2CHRNA4IDO1AGXTCYP3A4 | |
| SCHEMBL14173592 | 0.72 | SLC1A3 (0.42) | CHRNB2CHRNA4IDO1AGXTCYP3A4 | |
| SCHEMBL22433619 | 0.70 | IDO1 (0.46) | CHRNB2CHRNA4IDO1AGXTCA2 | |
| SCHEMBL17227561 | 0.69 | LOXL2 (0.43) | CHRNB2CHRNA4IDO1CYP3A4 | |
| SCHEMBL4299693 | 0.69 | IDO1 (0.50) | CHRNB2CHRNA4IDO1AGXTCA2 | |
| SCHEMBL7174942 | 0.69 | IDO1 (0.48) | IDO1CA2ABATMEN1CYP1A2 |
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-2139461-A2 | AMINO DERIVATIVES TO PREVENT NEPHROTOXICITY AND CANCER | Recepticon Aps (DK) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008113364-A2 | AMINO DERIVATIVES TO PREVENT NEPHROTOXICITY AND CANCER | RECEPTICON APS (DK) | 2008-09-25 | — | — | WO | disclosed |