Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.32 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10399319 | 1.00 | CES2 (0.36) | CES2LMNACES1MAPK1TDP1 | |
| SCHEMBL8822163 | 0.88 | CES2 (0.33) | CES2LMNACES1MAPK1TDP1 | |
| Hydrochloric Acid SCHEMBL28792392 | 0.86 | CES2 (0.36) | CES2LMNACES1MAPK1TDP1 | |
| SCHEMBL4582857 | 0.85 | CES2 (0.31) | CES2LMNACES1 | |
| SCHEMBL28945305 | 0.84 | CES1 (0.37) | CES2LMNACES1MAPK1TDP1 | |
| SCHEMBL11383230 | 0.83 | LMNA (0.36) | CES2LMNACES1MAPK1TDP1 | |
| SCHEMBL7638594 | 0.80 | HIF1A (0.37) | CES2LMNACES1MAPK1TDP1 | |
| SCHEMBL10371759 | 0.80 | CES2 (0.33) | CES2LMNACES1TDP1L3MBTL1 | |
| SCHEMBL8740392 | 0.80 | CTRB1 (0.38) | NPC1RAB9AMDM2 | |
| SCHEMBL27797096 | 0.78 | CES2 (0.34) | CES2LMNACES1TDP1L3MBTL1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4977144-A | ADENOSINE AGONISTS | CIBA-GEIGY CORPORATION (US) | 1990-12-11 | — | — | US | disclosed |
| US-4600771-A | Process for the preparation of acylated sugars with a glycosidically bonded isothiocyanate group | BAYER AKTIENGESELLSCHAFT (DE) | 1986-07-15 | — | — | US | disclosed |
| EP-0065324-A1 | 1,3-Diazepine compounds | THE UNITED STATES OF AMERICA as represented by the Secretary United States Department of Commerce (US) | 1982-11-24 | — | — | EP | disclosed |
| EP-0034424-A2 | Seven-membered ring compounds as inhibitors of cytidine deaminase | THE UNITED STATES OF AMERICA as represented by the Secretary United States Department of Commerce (US) | 1981-08-26 | — | — | EP | disclosed |
| WO-1981002164-A1 | SEVEN-MEMBERED RING COMPOUNDS AS INHIBITORS OF CYTIDINE DEAMINASE | US COMMERCE (US) | 1981-08-06 | — | — | WO | disclosed |
| US-4275057-A | CANCER AND ANTITUMOR DRUG RESEARCH | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH, EDUCATION AND WELFARE (US) | 1981-06-23 | — | — | US | disclosed |