Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | CPS1 | P31327 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL7785246 | 0.77 | SLC6A4 (0.34) | KDM4EMAPTRAB9ATRPA1ALDH1A1 | |
| SCHEMBL6814924 | 0.76 | CES2 (0.47) | CES2CES1KDM4EMAPTRAB9A | |
| SCHEMBL6814922 | 0.76 | CES2 (0.47) | CES2CES1KDM4EMAPTRAB9A | |
| SCHEMBL7784487 | 0.75 | RECQL (0.32) | CES2CES1 | |
| SCHEMBL6704054 | 0.74 | HIF1A (0.36) | CES2CES1ALDH1A1 | |
| SCHEMBL7784450 | 0.73 | PDE2A (0.38) | CES2KDM4EALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL6700710 | 0.71 | CES2 (0.50) | CES2CES1KDM4EMAPTCPS1 | |
| SCHEMBL6700713 | 0.71 | CES2 (0.50) | CES2CES1KDM4EMAPTCPS1 | |
| SCHEMBL7782666 | 0.70 | CES2 (0.41) | CES2CES1KDM4EMAPTCPS1 | |
| SCHEMBL6600961 | 0.70 | CES2 (0.41) | CES2CES1KDM4EMAPTCPS1 |
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-1140913-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000034269-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |