Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | POLB | P06746 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28258156 | 1.00 | TDP1 (0.64) | TDP1MAPTMEN1POLBKMT2A | |
| O-Tolylamine SCHEMBL25436024 | 0.86 | TDP1 (0.71) | TDP1MAPTMEN1POLBKMT2A | |
| SCHEMBL12117513 | 0.85 | HSD17B10 (0.58) | TDP1MAPTMEN1KMT2ATSHR | |
| SCHEMBL3270267 | 0.84 | S1PR1 (0.56) | TDP1MAPTMEN1POLBKMT2A | |
| SCHEMBL29655203 | 0.81 | TDP1 (0.64) | TDP1MAPTMEN1POLBKMT2A | |
| SCHEMBL27864754 | 0.81 | TDP1 (0.64) | TDP1MAPTMEN1POLBKMT2A | |
| SCHEMBL10714748 | 0.81 | TDP1 (0.64) | TDP1MAPTMEN1POLBKMT2A | |
| SCHEMBL719169 | 0.81 | TDP1 (0.64) | TDP1MAPTMEN1POLBKMT2A | |
| SCHEMBL29655079 | 0.81 | TDP1 (0.64) | TDP1MAPTMEN1POLBKMT2A | |
| SCHEMBL6318909 | 0.81 | ALDH1A1 (0.49) | TDP1MAPTMEN1KMT2ATSHR |
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 |