Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TSPO | P30536 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.39 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.39 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16701734 | 0.84 | SSTR4 (0.55) | RIPK1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL21574226 | 0.82 | RIPK1 (0.45) | RIPK1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL19208893 | 0.81 | SSTR4 (0.39) | RIPK1MAPTTP53SMN1; SMN2SSTR4 | |
| SCHEMBL21987976 | 0.79 | RIPK1 (0.50) | RIPK1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL20238374 | 0.79 | RIPK1 (0.42) | RIPK1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL16701459 | 0.78 | RIPK1 (0.41) | RIPK1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL1802024 | 0.77 | SSTR4 (0.45) | RIPK1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL1796402 | 0.76 | ALDH1A1 (0.44) | RIPK1ALDH1A1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL23819882 | 0.76 | RIPK1 (0.47) | RIPK1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL5080251 | 0.75 | RIPK1 (0.46) | RIPK1MAPTTP53ALDH1A1KDM4E |
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-2015069441-A1 | PYRAZOLO-, IMIDAZOLO- AND PYRROLO-PYRIDINE OR -PYRIMIDINE DERIVATIVES AS INHIBITORS O BRUTONS KINASE (BTK) | MEDIVATION TECHNOLOGIES, INC. (US) | 2015-05-14 | — | — | WO | disclosed |