Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 7/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PTGER2 | P43116 | 6/20 | 0.39 |
| ▸ | RARB | P10826 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19658184 | 0.91 | TDP1 (0.42) | CA1CA9TDP1PSMB8PSMB5 | |
| SCHEMBL13163608 | 0.87 | SRD5A2 (0.48) | TDP1ALDH1A1KMT2AMAPTHTT | |
| SCHEMBL18353920 | 0.87 | PSMB8 (0.37) | CA1CA9TDP1ALDH1A1PSMB8 | |
| SCHEMBL436079 | 0.86 | TDP1 (0.54) | TDP1ALDH1A1KMT2AMEN1GAA | |
| SCHEMBL112099 | 0.85 | FAAH (0.41) | TDP1ALDH1A1KMT2AMEN1POLB | |
| SCHEMBL13920679 | 0.84 | FFAR1 (0.42) | TDP1ALDH1A1KMT2AMEN1GAA | |
| SCHEMBL6193414 | 0.84 | MGLL (0.44) | ALDH1A1MAPT | |
| SCHEMBL8948701 | 0.84 | PSMB8 (0.37) | TDP1PSMB8PSMB5 | |
| SCHEMBL9752036 | 0.84 | L3MBTL1 (0.43) | TDP1ALDH1A1KMT2APOLBGAA | |
| SCHEMBL7453768 | 0.81 | F2RL1 (0.53) | TDP1ALDH1A1KMT2AMEN1POLB |
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-8133743-B2 | Phenobarbital derivatives useful in immunoassay | ROCHE DIAGNOSTICS OPERATIONS, INC. (US) | 2012-03-13 | — | — | US | disclosed |