Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PTPRC | P08575 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15522962 | 1.00 | TDP1 (0.50) | TDP1TSHRMAPK1MAPTPOLB | |
| SCHEMBL719169 | 0.88 | TDP1 (0.64) | TDP1TSHRMAPTPOLBMEN1 | |
| SCHEMBL29655079 | 0.88 | TDP1 (0.64) | TDP1TSHRMAPTPOLBMEN1 | |
| SCHEMBL27539548 | 0.85 | PTPRC (0.49) | TDP1TSHRMAPK1MAPTPOLB | |
| SCHEMBL6320483 | 0.82 | ALDH1A1 (0.53) | TDP1MAPK1MAPTPOLBMEN1 | |
| SCHEMBL28815846 | 0.81 | MAPT (0.44) | TDP1MAPTPOLBMEN1KMT2A | |
| SCHEMBL29655194 | 0.81 | BACE1 (0.47) | TDP1TSHRMAPK1MAPTPOLB | |
| SCHEMBL3973537 | 0.79 | MAPT (0.69) | TDP1TSHRMAPK1MAPTPOLB | |
| SCHEMBL2994172 | 0.79 | ERN1 (0.46) | TDP1PTPRCPTPN1ALDH1A1ATM | |
| SCHEMBL31570099 | 0.78 | MAPT (0.58) | TDP1TSHRMAPK1MAPTPOLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109843874-B | Phthalazine derivatives useful as inhibitors of PARP1, PARP2 and/or tubulin for the treatment of cancer | 加利福尼亚大学董事会 | 2022-05-27 | — | — | CN | disclosed |