Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 0.30 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4399555 | 1.00 | CHRM2 (0.36) | CHRM2CHRM1CHRM3DPP4CTSK | |
| SCHEMBL18166955 | 0.91 | CHRM2 (0.33) | CHRM2CHRM1CHRM3 | |
| SCHEMBL18166970 | 0.88 | CHRM2 (0.38) | CHRM2CHRM1CHRM3RIPK1 | |
| SCHEMBL14763728 | 0.84 | CHRM2 (0.40) | CHRM2CHRM1CHRM3CTSK | |
| SCHEMBL7284763 | 0.84 | CHRM2 (0.40) | CHRM2CHRM1CHRM3CTSK | |
| SCHEMBL27684119 | 0.81 | DPP4 (0.35) | DPP4CTSKRIPK1 | |
| SCHEMBL27780294 | 0.81 | DPP4 (0.35) | DPP4CTSKRIPK1 | |
| SCHEMBL27664587 | 0.81 | DPP4 (0.35) | DPP4CTSKRIPK1 | |
| SCHEMBL28265971 | 0.81 | ALDH1A1 (0.33) | CHRM3DPP4CTSKRIPK1 | |
| SCHEMBL27720226 | 0.79 | HRH2 (0.31) | — |
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-1973918-A2 | DERIVATIVES OF BETA-AMINO ACID AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS | RANBAXY LABORATORIES, LTD. (IN) | 2008-10-01 | — | — | EP | disclosed |
| WO-2007077508-A2 | DERIVATIVES OF BETA-AMINO ACID AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2007-07-12 | — | — | WO | disclosed |