Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 15/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2919116 | 0.76 | CHEK1 (0.53) | PARP1POLBKDM4ECA12CA9 | |
| SCHEMBL21230721 | 0.76 | PARP1 (0.48) | PARP1TDP1POLBKDM4ECA12 | |
| SCHEMBL2731038 | 0.76 | PARP1 (0.48) | PARP1KDM4ECA12CA9HSD17B10 | |
| SCHEMBL527840 | 0.76 | FEN1 (0.50) | PARP1KDM4ECA12CA9LMNA | |
| SCHEMBL5332369 | 0.76 | EGFR (0.50) | PARP1TDP1KDM4ECA12CA9 | |
| SCHEMBL2922284 | 0.76 | DAO (0.60) | PARP1KDM4ECA12CA9 | |
| SCHEMBL13857874 | 0.76 | PARP1 (0.48) | PARP1TDP1POLBKDM4ECA12 | |
| SCHEMBL30983620 | 0.75 | PARP1 (0.65) | PARP1TDP1POLBKDM4EMEN1 | |
| SCHEMBL3073008 | 0.75 | PARP1 (0.65) | PARP1TDP1POLBKDM4EMEN1 | |
| SCHEMBL2483323 | 0.75 | POLB (0.52) | PARP1TDP1POLBKDM4ECA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1222191-A2 | BENZODIAZEPIN DERIVATIVES, THE PRODUCTION AND USE THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-17 | — | — | EP | claimed |
| WO-2001023386-A2 | BENZODIAZEPIN DERIVATIVES, THE PRODUCTION AND USE THEREOF | BASF AKTIENGESELLSCHAFT (DE) | 2001-04-05 | — | — | WO | claimed |
| EP-1222191-B1 | BENZODIAZEPIN DERIVATIVES, THE PRODUCTION AND USE THEREOF | ABBOTT GMBH & CO KG (DE) | 2005-11-16 | — | — | EP | disclosed |