Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CTSG | P08311 | 1/20 | 0.40 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | MMP12 | P39900 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | MMP14 | P50281 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2312144 | 1.00 | HTT (0.46) | HTTMEN1KMT2ACTSGCTRB1 | |
| SCHEMBL4962348 | 0.73 | HTT (0.43) | HTTMEN1KMT2AOPRM1CHRM3 | |
| SCHEMBL7492223 | 0.72 | HTT (0.39) | HTTMEN1KMT2AOPRM1CHRM3 | |
| SCHEMBL5871034 | 0.70 | SLC6A2 (0.37) | HTTMEN1KMT2ACHRM3CHRM2 | |
| SCHEMBL18065715 | 0.66 | MMP12 (0.56) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL24726680 | 0.65 | OPRD1 (0.76) | OPRM1CHRM3CHRM2ADRA1AADRA1B | |
| SCHEMBL687094 | 0.65 | MMP12 (0.80) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL8333817 | 0.65 | MMP12 (0.80) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL4745347 | 0.65 | MMP12 (0.80) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL27109144 | 0.65 | KEAP1 (0.57) | HTTMEN1KMT2AADRA1AALDH1A1 |
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-2011092284-A1 | NOVEL AMINO ACID DERIVATIVES AND THEIR USE AS GPR43 RECEPTOR MODULATORS | EUROSCREEN S.A. (BE) | 2011-08-04 | — | — | WO | claimed |