Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.51 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.51 |
| ▸ | GNAI3 | P08754 | 8/20 | 0.47 |
| ▸ | GNAO1 | P09471 | 8/20 | 0.47 |
| ▸ | GNAI1 | P63096 | 8/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 5/20 | 0.39 |
| ▸ | PPARD | Q03181 | 5/20 | 0.39 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TLR2 | O60603 | 2/20 | 0.39 |
| ▸ | FABP4 | P15090 | 2/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31348822 | 0.87 | ABL1 (0.44) | ABL1RIN1GNAI3GNAO1GNAI1 | |
| SCHEMBL6141447 | 0.81 | CES2 (0.50) | ABL1RIN1TDP1MEN1KMT2A | |
| SCHEMBL31348819 | 0.81 | GAA (0.38) | ABL1RIN1GNAI3GNAO1GNAI1 | |
| SCHEMBL17713778 | 0.80 | GAA (0.42) | ABL1RIN1L3MBTL1ALDH1A1 | |
| SCHEMBL4911800 | 0.79 | CES2 (0.52) | TDP1MEN1KMT2APPARGPPARD | |
| SCHEMBL14215879 | 0.79 | CES2 (0.52) | TDP1MEN1KMT2APPARGPPARD | |
| SCHEMBL3885339 | 0.79 | CES2 (0.52) | TDP1MEN1KMT2APPARGPPARD | |
| SCHEMBL6571414 | 0.79 | CES2 (0.52) | TDP1MEN1KMT2APPARGPPARD | |
| SCHEMBL14215972 | 0.79 | CES2 (0.52) | TDP1MEN1KMT2APPARGPPARD | |
| SCHEMBL20382507 | 0.79 | CES2 (0.52) | TDP1MEN1KMT2APPARGPPARD |
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-105153119-A | Pyridylpyrimidyl amine compounds or pyridylpyridyl amine compounds and application thereof | GUANGZHOU KEQIN NEW MEDICINE DESIGN CO LTD | 2015-12-16 | — | — | CN | disclosed |