Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 5/20 | 0.40 |
| ▸ | CA6 | P23280 | 5/20 | 0.40 |
| ▸ | CA7 | P43166 | 5/20 | 0.40 |
| ▸ | CA9 | Q16790 | 5/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA4 | P22748 | 4/20 | 0.39 |
| ▸ | CA5A | P35218 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | CA3 | P07451 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4124680 | 0.79 | CYP2C19 (0.56) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL27892766 | 0.77 | CYP2C19 (0.54) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL1263734 | 0.75 | CYP2C19 (0.52) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL19458012 | 0.75 | CHRM2 (0.44) | CA12CA6CA7CA9CA14 | |
| SCHEMBL9577224 | 0.73 | CYP2C19 (0.50) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL18797279 | 0.72 | CYP2C19 (0.48) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL20612742 | 0.71 | CA12 (0.46) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL3693736 | 0.71 | CYP2C19 (0.47) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL10108999 | 0.70 | CYP2C19 (0.56) | CYP2C19CYP2C9CA12CA6CA7 | |
| SCHEMBL8766711 | 0.69 | CYP2C19 (0.50) | CYP2C19CYP2C9CA12CA6CA7 |
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-2008112636-A1 | CHAIN EXTENDERS | ALBEMARLE CORPORATION (US) | 2008-09-18 | — | — | WO | disclosed |