Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 2/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | FCER2 | P06734 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ACP1 | P24666 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6988734 | 1.00 | CYP1A2 (0.41) | CYP1A2MMP2MMP9MMP8MMP13 | |
| SCHEMBL6988573 | 0.93 | CYP1A2 (0.42) | CYP1A2MMP2MMP9MMP8MMP13 | |
| SCHEMBL6987203 | 0.85 | CYP1A2 (0.38) | CYP1A2MMP2MMP9MMP8MMP13 | |
| SCHEMBL6989198 | 0.85 | CYP1A2 (0.43) | CYP1A2MMP2MMP9MMP8MMP13 | |
| Hydrochloric Acid SCHEMBL6985055 | 0.84 | CYP1A2 (0.42) | CYP1A2MMP2MMP9MMP8MMP13 | |
| SCHEMBL6987672 | 0.81 | HDAC3 (0.38) | CYP1A2MMP2MMP9MMP8MMP13 | |
| SCHEMBL6987677 | 0.81 | HDAC3 (0.38) | CYP1A2MMP2MMP9MMP8MMP13 | |
| SCHEMBL6987795 | 0.80 | CYP1A2 (0.43) | CYP1A2MMP2MMP9MMP8MMP13 | |
| SCHEMBL27578438 | 0.79 | TRPV1 (0.44) | CYP1A2KMT2AMEN1TRPV1HIF1A | |
| SCHEMBL6987897 | 0.79 | MMP2 (0.35) | CYP1A2MMP2MMP9MMP8MMP13 |
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-1289980-A1 | BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES | SMITHKLINE BEECHAM PLC (GB) | 2003-03-12 | — | — | EP | disclosed |
| WO-2001090100-A1 | BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-11-29 | — | — | WO | disclosed |