Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.50 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24262858 | 0.85 | GPR84 (0.50) | GPR84KMT2AKDM4ETSHRNPC1 | |
| SCHEMBL3750536 | 0.84 | NQO1 (0.50) | NQO1KMT2AFFAR1FFAR4KDM4E | |
| SCHEMBL1632709 | 0.83 | SMN1; SMN2 (0.47) | NQO1KMT2AKDM4EMEN1HPGD | |
| SCHEMBL9425356 | 0.81 | NQO1 (0.56) | NQO1KMT2AKDM4ETSHRTDP1 | |
| SCHEMBL1548013 | 0.81 | KDM4E (0.58) | NQO1KMT2AFFAR1FFAR4KDM4E | |
| SCHEMBL30905970 | 0.79 | CA12 (0.46) | GPR84KMT2AKDM4ETSHRTDP1 | |
| SCHEMBL322093 | 0.79 | CA12 (0.46) | GPR84KMT2AKDM4ETSHRTDP1 | |
| SCHEMBL13425464 | 0.78 | ALDH1A1 (0.49) | NQO1GPR84KMT2AFFAR1KDM4E | |
| SCHEMBL30753685 | 0.78 | NQO1 (0.52) | NQO1KMT2AKDM4ETSHRTDP1 | |
| SCHEMBL15057334 | 0.78 | NQO1 (0.52) | NQO1KMT2AKDM4ETSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106986867-B | Heterocycle amine as PI3K inhibitor | 因塞特控股公司 | 2019-06-28 | — | — | CN | disclosed |
| CN-109010343-A | The purposes of Pyrazolopyrimidine derivative treatment PI3K δ associated disease | 因赛特公司 | 2018-12-18 | — | — | CN | disclosed |