Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.54 |
| ▸ | CTSC | P53634 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL18155287 | 0.85 | ESR1 (0.54) | CTSCHPGDMEN1KMT2ANPC1 | |
| SCHEMBL21092645 | 0.85 | ESR1 (0.54) | CTSCHPGDMEN1KMT2ANPC1 | |
| SCHEMBL22251574 | 0.85 | ESR1 (0.54) | CTSCHPGDMEN1KMT2ANPC1 | |
| SCHEMBL18710626 | 0.85 | ESR1 (0.54) | CTSCHPGDMEN1KMT2ANPC1 | |
| SCHEMBL29340506 | 0.83 | GRK2 (0.49) | CTSCHPGDMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL21585402 | 0.83 | DPP4 (0.56) | DPP4CTSCMAPTHPGDMEN1 | |
| SCHEMBL21585407 | 0.83 | DPP4 (0.56) | DPP4CTSCMAPTHPGDMEN1 | |
| SCHEMBL24322672 | 0.83 | DPP4 (0.56) | DPP4CTSCMAPTHPGDMEN1 | |
| SCHEMBL29302666 | 0.82 | HDAC3 (0.43) | DPP4CTSCDEGS1HSD17B10NAMPT | |
| SCHEMBL30945059 | 0.81 | DPP4 (0.54) | DPP4CTSCMAPTHPGDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023036140-A1 | 3CLPRO PROTEASE INHIBITOR | 上海齐鲁制药研究中心有限公司 | 2023-03-16 | — | — | WO | disclosed |