Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | AGXT | P21549 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27585418 | 0.87 | MPO (0.37) | PKMIDO1AGXTHDAC3HDAC1 | |
| SCHEMBL28097258 | 0.87 | PKM (0.41) | PKMHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL27726752 | 0.85 | IDO1 (0.37) | PKMIDO1AGXTHDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL27862891 | 0.83 | IDO1 (0.39) | PKMIDO1AGXTHDAC3HDAC1 | |
| SCHEMBL6650657 | 0.83 | CYP4F2 (0.44) | PKMHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL28963048 | 0.80 | MEN1 (0.36) | PKMHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL28963079 | 0.79 | LMNA (0.38) | PKMHDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL11712958 | 0.79 | MEN1 (0.39) | MEN1KMT2AALDH1A1 | |
| SCHEMBL27469437 | 0.78 | PKM (0.39) | PKMMPOSLC6A4MEN1KMT2A | |
| SCHEMBL27524200 | 0.77 | FFAR1 (0.46) | PKMMEN1KMT2AALDH1A1FFAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105530932-B | Primary formamide as BTK inhibitor | 艾伯维公司 | 2019-09-27 | — | — | CN | disclosed |
| CN-108697684-A | The conditioning agent of chemokine receptors | 凯莫森特里克斯股份有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-104230827-B | 1-(aryl methyl) quinazoline-2,4 (1H, 3H)-diketone is as PARP inhibitor and application thereof | 南京英派药业有限公司 | 2016-10-26 | — | — | CN | disclosed |
| CN-105530932-A | Primary carboxamides as BIK inhibitors | ABBVIE INC | 2016-04-27 | — | — | CN | disclosed |