Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | MMP3 | P08254 | 2/20 | 0.38 |
| ▸ | MMP7 | P09237 | 2/20 | 0.38 |
| ▸ | MMP10 | P09238 | 2/20 | 0.38 |
| ▸ | MMP9 | P14780 | 2/20 | 0.38 |
| ▸ | MMP8 | P22894 | 2/20 | 0.38 |
| ▸ | MMP12 | P39900 | 2/20 | 0.38 |
| ▸ | MMP14 | P50281 | 2/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL5020143 | 0.91 | MMP8 (0.39) | BRD4CREBBPMMP1MMP2MMP3 | |
| SCHEMBL5020180 | 0.91 | GAA (0.43) | HDAC1MMP1MMP2MMP3MMP7 | |
| SCHEMBL8777624 | 0.76 | BRD4 (0.41) | BRD4CREBBPCTSBCTSSCTSK | |
| SCHEMBL30504293 | 0.75 | HDAC1 (0.56) | BRD4CREBBPCTSBCTSSCTSK | |
| SCHEMBL18664426 | 0.73 | HDAC1 (0.60) | BRD4CREBBPCTSBCTSSCTSK | |
| SCHEMBL2568359 | 0.72 | HDAC1 (0.56) | BRD4CREBBPCTSBCTSSCTSK | |
| SCHEMBL301717 | 0.71 | PRMT6 (0.56) | BRD4CREBBPCTSBCTSSCTSK | |
| SCHEMBL6242494 | 0.71 | HDAC1 (0.55) | BRD4CREBBPCTSBCTSSCTSK | |
| SCHEMBL18664572 | 0.71 | GRM2 (0.54) | BRD4CREBBPCTSBCTSSCTSK | |
| SCHEMBL5549803 | 0.70 | HDAC1 (0.60) | BRD4CREBBPCTSBCTSSCTSK |
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-2012064943-A2 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2012-05-18 | — | — | WO | disclosed |