Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 10/20 | 0.47 |
| ▸ | CA9 | Q16790 | 9/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 8/20 | 0.44 |
| ▸ | CA12 | O43570 | 7/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL5034960 | 0.94 | CA2 (0.48) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5035314 | 0.93 | KMT2A (0.39) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5041510 | 0.88 | CA2 (0.52) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5034907 | 0.88 | KIF18A (0.45) | CA2CA9KMT2AKDM4EHTT | |
| SCHEMBL5039326 | 0.86 | KMT2A (0.40) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5049382 | 0.86 | CA2 (0.53) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5039198 | 0.84 | CA2 (0.48) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5039328 | 0.84 | CA2 (0.46) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5035270 | 0.84 | MAPK1 (0.54) | CA2CA9KMT2AMEN1ALDH1A1 | |
| SCHEMBL5034946 | 0.82 | RIPK2 (0.43) | CA2CA9KMT2AMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1761541-B1 | PYRRAZOLO-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-01-09 | — | — | EP | claimed |