Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 5/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL25415051 | 0.79 | TDP1 (0.67) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL21742339 | 0.77 | TDP1 (0.59) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL453989 | 0.77 | TDP1 (0.59) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL21742348 | 0.77 | TDP1 (0.59) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL18803863 | 0.76 | TDP1 (0.62) | TDP1RAB9ANPC1MEN1KMT2A | |
| Methyl Alcohol SCHEMBL28478479 | 0.75 | NPC1 (0.89) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL229328 | 0.75 | NPC1 (1.00) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL31560044 | 0.75 | NPC1 (1.00) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL9394256 | 0.75 | NPC1 (1.00) | TDP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL229329 | 0.75 | NPC1 (1.00) | TDP1RAB9ANPC1MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3611164-A1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | Mitsui Chemicals Agro, Inc. (JP) | 2020-02-19 | — | — | EP | disclosed |
| CN-105237557-B | Metal complexes with boron-nitrogen heterocycle containing ligands for use in organic light emitting devices | 通用显示公司 | 2017-04-19 | — | — | CN | disclosed |