Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | CTRC | Q99895 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MPI | P34949 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3415539 | 0.88 | ALDH1A1 (0.53) | PARP1CYP2A6ALDH1A1BACE1ALOX5 | |
| SCHEMBL29728323 | 0.88 | ALDH1A1 (0.53) | PARP1CYP2A6ALDH1A1BACE1ALOX5 | |
| SCHEMBL2391683 | 0.79 | ALDH1A1 (0.52) | PARP1CYP2A6ALDH1A1BACE1HPGD | |
| SCHEMBL29444814 | 0.79 | PARP1 (0.43) | PARP1CYP2A6ALDH1A1BACE1ALOX5 | |
| SCHEMBL21214803 | 0.79 | CYP1A2 (0.67) | CYP2A6ALDH1A1CTRCKDM4EMEN1 | |
| SCHEMBL2448362 | 0.79 | PARP1 (0.43) | PARP1CYP2A6ALDH1A1BACE1ALOX5 | |
| SCHEMBL30363359 | 0.79 | CYP1A2 (0.67) | CYP2A6ALDH1A1CTRCKDM4EMEN1 | |
| SCHEMBL14375337 | 0.79 | CYP2A6 (0.65) | PARP1CYP2A6ALDH1A1BACE1ALOX5 | |
| SCHEMBL17242010 | 0.79 | PARP1 (0.43) | PARP1CYP2A6ALDH1A1BACE1ALOX5 | |
| SCHEMBL27723481 | 0.78 | ALDH1A1 (0.46) | PARP1CYP2A6ALDH1A1BACE1ALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| US-7393560-B2 | Organo-metal compounds | BRAGGONE OY (FI) | 2008-07-01 | — | — | US | claimed |
| US-20060263621-A1 | Novel organo-metal compounds | BRAGGONE OY (FI) | 2006-11-23 | — | — | US | claimed |
| US-7393560-B2 | Organo-metal compounds | BRAGGONE OY (FI) | 2008-07-01 | — | — | US | disclosed |
| US-20060263621-A1 | Novel organo-metal compounds | BRAGGONE OY (FI) | 2006-11-23 | — | — | US | disclosed |