Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 7/20 | 0.64 |
| ▸ | CDK1 | P06493 | 3/20 | 0.64 |
| ▸ | NEK2 | P51955 | 2/20 | 0.64 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.64 |
| ▸ | CDK7 | P50613 | 2/20 | 0.64 |
| ▸ | AURKA | O14965 | 1/20 | 0.64 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.64 |
| ▸ | ABL1 | P00519 | 1/20 | 0.64 |
| ▸ | LCK | P06239 | 1/20 | 0.64 |
| ▸ | FYN | P06241 | 1/20 | 0.64 |
| ▸ | LYN | P07948 | 1/20 | 0.64 |
| ▸ | MET | P08581 | 1/20 | 0.64 |
| ▸ | SRC | P12931 | 1/20 | 0.64 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.64 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | AKT2 | P31751 | 1/20 | 0.64 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.64 |
| ▸ | GSK3B | P49841 | 1/20 | 0.64 |
| ▸ | PLK1 | P53350 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL459414 | 0.83 | ADORA3 (0.68) | CDK2CDK1NEK2CHEK1CDK7 | |
| SCHEMBL16147019 | 0.82 | POLA1 (0.65) | CDK2CDK1NEK2CHEK1CDK7 | |
| SCHEMBL16147002 | 0.82 | CDK2 (0.64) | CDK2CDK1NEK2CHEK1CDK7 | |
| SCHEMBL8369496 | 0.79 | CDK1 (0.62) | CDK2CDK1MAPK1POLA1ADORA3 | |
| SCHEMBL8539781 | 0.77 | MAPK1 (0.50) | CDK2CDK1NEK2CHEK1CDK7 | |
| SCHEMBL7112087 | 0.76 | CDK2 (0.62) | CDK2CDK1NEK2CHEK1CDK7 | |
| SCHEMBL3001381 | 0.76 | TNNI3K (0.61) | SRC | |
| SCHEMBL27824249 | 0.76 | DPP4 (0.61) | CDK2POLA1ADORA3PDPK1 | |
| SCHEMBL5779077 | 0.74 | POLA1 (0.60) | CDK2NEK2POLA1PDPK1JAK2 | |
| SCHEMBL7666283 | 0.74 | POLA1 (0.60) | CDK2CDK1NEK2CDK7POLA1 |
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-0794781-A4 | DRUGS TO PREVENT RECURRENT HERPES VIRUS INFECTIONS | UNIV MASSACHUSETTS MEDICAL (US) | 1998-04-22 | — | — | EP | disclosed |
| EP-0794781-A1 | DRUGS TO PREVENT RECURRENT HERPES VIRUS INFECTIONS | UNIVERSITY OF MASSACHUSETTS MEDICAL CENTER (US) | 1997-09-17 | — | — | EP | disclosed |
| US-5646155-A | ADMINISTERING A 9-SUBSTITUTED-N2-PHENYLGUANINE DERIVATIVE | UNIVERSITY OF MASSACHUSETTS MEDICAL CENTER (US) | 1997-07-08 | — | — | US | disclosed |
| WO-1996020711-A1 | DRUGS TO PREVENT RECURRENT HERPES VIRUS INFECTIONS | UNIVERSITY OF MASSACHUSETTS MEDICAL CENTER (US) | 1996-07-11 | — | — | WO | disclosed |