Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.73 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.41 |
| ▸ | CCR1 | P32246 | 2/20 | 0.39 |
| ▸ | CCR5 | P51681 | 2/20 | 0.39 |
| ▸ | CCR8 | P51685 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | P4HTM | Q9NXG6 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | METAP1 | P53582 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | DOHH | Q9BU89 | 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 | |
|---|---|---|---|---|
| 2-Chloropyridine SCHEMBL27506304 | 0.88 | TDP1 (0.76) | TDP1MEN1NPC1RAB9AKMT2A | |
| 2-Chloropyridine SCHEMBL27294981 | 0.86 | TDP1 (0.73) | TDP1MEN1NPC1RAB9AKMT2A | |
| 2-Chloropyridine SCHEMBL27596465 | 0.86 | TDP1 (0.73) | TDP1MEN1NPC1RAB9AKMT2A | |
| 2-Chloropyridine SCHEMBL28283236 | 0.85 | TDP1 (0.64) | TDP1MEN1NPC1RAB9AKMT2A | |
| 2-Chloropyridine SCHEMBL16637 | 0.85 | — | — | |
| 2-Chloropyridine SCHEMBL28283275 | 0.85 | TDP1 (1.00) | TDP1MEN1NPC1RAB9AKMT2A | |
| 2-Chloropyridine SCHEMBL10690176 | 0.85 | TDP1 (1.00) | TDP1MEN1NPC1RAB9AKMT2A | |
| 2-Chloropyridine SCHEMBL29402311 | 0.85 | — | — | |
| 2-Chloropyridine SCHEMBL11389784 | 0.85 | — | — | |
| 2-Chloropyridine SCHEMBL28016734 | 0.84 | TDP1 (0.70) | TDP1MEN1NPC1RAB9AKMT2A |
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-106170489-B | New Pyrazolopyrimidine derivative and its purposes as MALT1 inhibitor | 诺华股份有限公司 | 2019-05-03 | — | — | CN | disclosed |