Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.69 |
| ▸ | NPC1 | O15118 | 3/20 | 0.60 |
| ▸ | RAB9A | P51151 | 3/20 | 0.60 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.50 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.49 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.49 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | ESRRB | O95718 | 1/20 | 0.46 |
| ▸ | ESRRG | P62508 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29077678 | 0.85 | HPGD (0.71) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL10282412 | 0.82 | RAB9A (0.86) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL1820539 | 0.82 | HPGD (0.68) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL4516890 | 0.82 | HPGD (0.68) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL20056512 | 0.81 | HPGD (0.62) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| Water SCHEMBL27924604 | 0.81 | HPGD (0.66) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL12672349 | 0.81 | HPGD (0.66) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL4043511 | 0.80 | HPGD (0.64) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL22845271 | 0.78 | HPGD (0.62) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 | |
| SCHEMBL104356 | 0.78 | HPGD (0.62) | HPGDNPC1RAB9AP2RX7SMN1; SMN2 |
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-110818634-B | Refining method of lervatinib mesylate | 上海新礼泰药业有限公司 | 2021-11-30 | — | — | CN | disclosed |
| CN-110818634-A | Refining method of lervatinib mesylate | 上海博志研新药物技术有限公司 | 2020-02-21 | — | — | CN | disclosed |