Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.31 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6809967 | 0.87 | CA12 (0.33) | CYP1A2CYP2D6SCN9ACA12CA1 | |
| SCHEMBL3970324 | 0.73 | MEN1 (0.32) | MCHR1NPBWR1MEN1KMT2A | |
| SCHEMBL4443398 | 0.71 | BRD4 (0.38) | HDAC1L3MBTL1 | |
| SCHEMBL4055424 | 0.68 | HDAC1 (0.46) | HDAC1PTGER4PTGER2KDM4EMEN1 | |
| SCHEMBL4059741 | 0.68 | BRD4 (0.37) | MCHR1NPBWR1HDAC1KDM4EL3MBTL1 | |
| SCHEMBL6460901 | 0.68 | MEN1 (0.46) | HDAC1MEN1KMT2A | |
| SCHEMBL3972127 | 0.66 | ADRA2C (0.35) | CYP1A2CYP2D6MCHR1NPBWR1CA12 | |
| SCHEMBL3964825 | 0.65 | HDAC1 (0.56) | HDAC1KDM4EMEN1POLBMAPT | |
| SCHEMBL27672051 | 0.63 | MAOA (0.50) | HDAC1TDP1 | |
| SCHEMBL4053053 | 0.62 | TSHR (0.31) | MEN1KMT2AL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6770647-B2 | Bicyclic hydroxamates as inhibitors of matrix metalloproteinases and/or TNF-α converting enzyme (TACE) | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2004-08-03 | — | — | US | disclosed |