Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 3/20 | 0.65 |
| ▸ | MMP13 | P45452 | 3/20 | 0.65 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.55 |
| ▸ | MME | P08473 | 3/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.47 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 1/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.46 |
| ▸ | CTSC | P53634 | 2/20 | 0.45 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.44 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
| ▸ | GPR34 | Q9UPC5 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | CPA3 | P15088 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3467200 | 0.93 | MMP12 (0.60) | MMP12MMP13FOLH1MMEFFAR1 | |
| SCHEMBL3466325 | 0.91 | FFAR1 (0.57) | MMP12MMP13FOLH1FFAR1ADAMTS4 | |
| SCHEMBL7928277 | 0.89 | MMP12 (0.64) | MMP12MMP13FOLH1MMEFFAR1 | |
| SCHEMBL7932591 | 0.88 | MMP12 (0.63) | MMP12MMP13FOLH1MMEFFAR1 | |
| SCHEMBL7923446 | 0.83 | MMP12 (0.57) | MMP12MMP13FOLH1MMEFFAR1 | |
| SCHEMBL3465875 | 0.83 | MMP12 (0.65) | MMP12MMP13MMEFFAR1ACE | |
| SCHEMBL7917889 | 0.82 | MMP12 (0.55) | MMP12MMP13FOLH1MMEFFAR1 | |
| SCHEMBL3467249 | 0.81 | MMP12 (0.54) | MMP12MMP13FOLH1FFAR1ADAMTS4 | |
| SCHEMBL3466565 | 0.81 | GPR34 (0.54) | MMP12MMP13FFAR1ADAMTS4FFAR4 | |
| SCHEMBL12646477 | 0.80 | FFAR1 (0.70) | MMP12MMP13MMEFFAR1XDH |
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-2010070076-A1 | ALKANOIC ACID DERIVATIVES AND THEIR THERAPEUTIC USE AS HDAC INHIBITORS | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2010-06-24 | — | — | WO | disclosed |