Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30211465 | 0.80 | L3MBTL1 (0.34) | KDM4ENOTUMTSHRALDH1A1L3MBTL1 | |
| SCHEMBL4131647 | 0.79 | NR1H2 (0.42) | KDM4ENOTUML3MBTL1 | |
| SCHEMBL1254373 | 0.78 | CYP1A2 (0.46) | KDM4ENOTUMTSHRL3MBTL1NPSR1 | |
| SCHEMBL21587971 | 0.77 | NOTUM (0.33) | KDM4ENOTUMALDH1A1L3MBTL1GAA | |
| SCHEMBL1966318 | 0.76 | NPSR1 (0.37) | KDM4ENOTUMTSHRALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL29155899 | 0.75 | NPSR1 (0.36) | KDM4ENOTUMTSHRALDH1A1L3MBTL1 | |
| SCHEMBL1003620 | 0.75 | ALDH1A1 (0.41) | KDM4EALDH1A1L3MBTL1GAANPSR1 | |
| SCHEMBL20562638 | 0.74 | NR4A2 (0.42) | KDM4ENOTUMTSHRALDH1A1NR4A2 | |
| SCHEMBL16142787 | 0.73 | NR4A2 (0.49) | KDM4ETSHRALDH1A1L3MBTL1GAA | |
| SCHEMBL19100596 | 0.71 | KDM4E (0.43) | KDM4ETSHRALDH1A1GAAHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3538528-A1 | PYRROLE AMIDES AS ALPHA V INTEGRIN INHIBITORS | Bristol-Myers Squibb Company (US) | 2019-09-18 | — | — | EP | disclosed |
| WO-2018089360-A1 | PYRROLE AMIDES AS ALPHA V INTEGRIN INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-05-17 | — | — | WO | disclosed |