Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | DBH | P09172 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | FNTA | P49354 | 1/20 | 0.40 |
| ▸ | FNTB | P49356 | 1/20 | 0.40 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29630801 | 0.81 | L3MBTL1 (0.50) | CYP11B1CYP11B2CYP19A1ALDH1A1KDM4E | |
| SCHEMBL27862340 | 0.80 | CA12 (0.44) | CYP11B1CYP11B2CYP19A1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1680294 | 0.75 | NPC1 (0.58) | NPC1RAB9ACYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL3260891 | 0.75 | NPC1 (0.71) | NPC1RAB9ACYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL13692247 | 0.74 | SMN1; SMN2 (0.54) | NPC1RAB9ACYP11B1CYP11B2CYP19A1 | |
| SCHEMBL511716 | 0.73 | NPC1 (0.55) | NPC1RAB9ACYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL920867 | 0.70 | NPC1 (0.55) | NPC1RAB9ACYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL28226586 | 0.70 | GRM5 (0.48) | — | |
| SCHEMBL1106879 | 0.70 | NPC1 (0.51) | NPC1RAB9ACYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL28188544 | 0.69 | — | — |
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-113896673-B | Amide derivatives as prostaglandin EP4 receptor antagonists and uses thereof | 安润医药科技（苏州）有限公司 | 2023-05-05 | — | — | CN | disclosed |
| WO-2022111222-A1 | AMIDE DERIVATIVE SERVING AS PROSTAGLANDIN EP4 RECEPTOR ANTAGONIST, AND USE THEREOF | 安润医药科技（苏州）有限公司 | 2022-06-02 | — | — | WO | disclosed |