Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | ALPL | P05186 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.32 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17303477 | 0.85 | RXFP1 (0.44) | ALDH1A1MAPTCA12KDM4EMAPK1 | |
| SCHEMBL1111577 | 0.83 | KDM4E (0.47) | ALDH1A1KDM4ECHEK1POLBRAB9A | |
| SCHEMBL3086806 | 0.81 | MAPK1 (0.48) | ALDH1A1CA12MAPK1CA9MAP4K4 | |
| SCHEMBL10242672 | 0.81 | XDH (0.49) | MAPTADORA3RAB9ALMNAXDH | |
| Hydrochloric Acid SCHEMBL31747485 | 0.80 | MAPK1 (0.47) | ALDH1A1CA12MAPK1CA9MAP4K4 | |
| SCHEMBL16766999 | 0.79 | LMNA (0.36) | MAPTMAPK1METAP2NOTUMPOLB | |
| SCHEMBL3225115 | 0.79 | MEN1 (0.50) | ALDH1A1MAPTCA12MAPK1CA9 | |
| SCHEMBL182044 | 0.79 | ALDH1A1 (0.55) | ALDH1A1ALPLMAPTCA12KDM4E | |
| Bicarbonate SCHEMBL7945138 | 0.75 | TP53 (0.47) | ALDH1A1KDM4EMETAP2CHEK1ADORA3 | |
| SCHEMBL28005157 | 0.74 | METAP2 (0.32) | METAP2ADORA3LMNAXDH |
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-1945641-A1 | HEPATITIS C VIRUS INHIBITORS | Brystol-Myers Squibb Company (US) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007044933-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-04-19 | — | — | WO | disclosed |