Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | PHGDH | O43175 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA3 | P07451 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA6 | P23280 | 1/20 | 0.49 |
| ▸ | CA5A | P35218 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.49 |
| ▸ | ERN1 | O75460 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28744516 | 0.86 | HSP90AA1 (0.55) | HSP90AA1KDM4EPHGDHHTTMAPT | |
| SCHEMBL23021686 | 0.79 | KDM4E (0.61) | HSP90AA1KDM4EPHGDHHTTMAPT | |
| SCHEMBL487433 | 0.79 | KDM4E (0.75) | HSP90AA1KDM4EPHGDHHTTMAPT | |
| SCHEMBL6862139 | 0.79 | KMT2A (0.54) | KDM4EHTTMAPTTSHRSMN1; SMN2 | |
| SCHEMBL18299399 | 0.76 | ERN1 (0.58) | HSP90AA1KDM4EPHGDHHTTMAPT | |
| SCHEMBL18299935 | 0.76 | KDM4E (0.57) | HSP90AA1KDM4EHTTMAPTTSHR | |
| SCHEMBL18299000 | 0.76 | KDM4E (0.57) | HSP90AA1KDM4EHTTMAPTTSHR | |
| SCHEMBL4469583 | 0.75 | TSHR (0.71) | HSP90AA1KDM4EHTTMAPTTSHR | |
| SCHEMBL29486100 | 0.75 | GAA (0.52) | HSP90AA1KDM4EPHGDHHTTMAPT | |
| SCHEMBL28746378 | 0.75 | GAA (0.52) | HSP90AA1KDM4EPHGDHHTTMAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0973730-B1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 2004-06-16 | — | — | EP | disclosed |
| US-6294531-B1 | AMINOALKANOLS AS BLOOD COAGULANTS | SMITHKLINE BEECHAM CORPORATION | 2001-09-25 | — | — | US | disclosed |
| EP-0973730-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998045255-A1 | CALCILYTIC COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 1998-10-15 | — | — | WO | disclosed |