Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPG | Q9Y5X9 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | MMP9 | P14780 | 1/20 | 0.30 |
| ▸ | MMP8 | P22894 | 1/20 | 0.30 |
| ▸ | MMP13 | P45452 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18109442 | 0.86 | ABCB1 (0.42) | MDM2 | |
| SCHEMBL18109438 | 0.86 | ABCB1 (0.42) | MDM2 | |
| SCHEMBL19461020 | 0.86 | ABCB1 (0.42) | MDM2 | |
| SCHEMBL6063753 | 0.75 | ELANE (0.36) | MDM2 | |
| SCHEMBL6063582 | 0.75 | ELANE (0.36) | MDM2 | |
| SCHEMBL6918361 | 0.74 | ELANE (0.35) | PTGDR2 | |
| SCHEMBL22636048 | 0.74 | ELANE (0.35) | PTGDR2 | |
| SCHEMBL20134719 | 0.73 | ABCB1 (0.43) | — | |
| SCHEMBL18109300 | 0.73 | ABCB1 (0.43) | — | |
| SCHEMBL18109299 | 0.73 | ABCB1 (0.43) | — |
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-112174960-A | Toll-like receptor modulating 4, 6-diamino-pyrido [3,2-D ] pyrimidine compounds | 吉利德科学公司 | 2021-01-05 | — | — | CN | disclosed |
| CN-107108615-B | Toll-like receptor modulating 4, 6-diamino-pyrido [3,2-D ] pyrimidine compounds | 吉利德科学公司 | 2020-11-20 | — | — | CN | disclosed |