Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 2/20 | 0.51 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.51 |
| ▸ | MMP12 | P39900 | 1/20 | 0.51 |
| ▸ | P4HB | P07237 | 1/20 | 0.46 |
| ▸ | GPR27 | Q9NS67 | 2/20 | 0.45 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.45 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.44 |
| ▸ | ACLY | P53396 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ATIC | P31939 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3467103 | 0.88 | MMP13 (0.46) | MMP13ADAMTS4MMP12ACLYCNR1 | |
| SCHEMBL7928277 | 0.87 | MMP12 (0.64) | MMP13ADAMTS4MMP12MMP2MMP3 | |
| SCHEMBL7932591 | 0.86 | MMP12 (0.63) | MMP13ADAMTS4MMP12MMP2MMP3 | |
| SCHEMBL1860527 | 0.83 | HDAC1 (0.54) | MMP2MMP3HDAC1HDAC8 | |
| SCHEMBL3467249 | 0.79 | MMP12 (0.54) | MMP13ADAMTS4MMP12MMP2MMP3 | |
| SCHEMBL1858150 | 0.79 | LIMK2 (0.54) | HDAC1HDAC8 | |
| SCHEMBL7917889 | 0.78 | MMP12 (0.55) | MMP13ADAMTS4MMP12MMP2MMP3 | |
| SCHEMBL3466770 | 0.78 | MMP13 (0.45) | MMP13ADAMTS4MMP12CNR1CNR2 | |
| SCHEMBL8039484 | 0.78 | HTR6 (0.58) | MMP2MMP3HDAC1HDAC8 | |
| SCHEMBL7924636 | 0.78 | MMP12 (0.65) | MMP13ADAMTS4MMP12MMP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010070076-A1 | ALKANOIC ACID DERIVATIVES AND THEIR THERAPEUTIC USE AS HDAC INHIBITORS | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2010-06-24 | — | — | WO | claimed |
| WO-2010070076-A1 | ALKANOIC ACID DERIVATIVES AND THEIR THERAPEUTIC USE AS HDAC INHIBITORS | CRYSTAX PHARMACEUTICALS, S.L. (ES) | 2010-06-24 | — | — | WO | disclosed |