Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.65 |
| ▸ | RAB9A | P51151 | 6/20 | 0.65 |
| ▸ | CASP3 | P42574 | 1/20 | 0.65 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.65 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.65 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.65 |
| ▸ | ALPL | P05186 | 7/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | CNR1 | P21554 | 3/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | DPP4 | P27487 | 2/20 | 0.51 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL25188817 | 0.78 | ALPL (0.56) | ALPLMEN1KMT2ATP53HPGD | |
| SCHEMBL29586580 | 0.77 | GRM5 (0.42) | NPC1RAB9ACASP3SENP8SENP7 | |
| SCHEMBL29114990 | 0.75 | NPC1 (0.65) | NPC1RAB9ACNR1HPGDCNR2 | |
| SCHEMBL24424425 | 0.75 | NPC1 (0.42) | NPC1RAB9ACASP3SENP8SENP7 | |
| SCHEMBL5354418 | 0.73 | CNR1 (1.00) | NPC1RAB9ACASP3SENP8SENP7 | |
| SCHEMBL29114930 | 0.71 | NPSR1 (0.59) | NPC1RAB9AALPLKMT2AHPGD | |
| SCHEMBL29944105 | 0.70 | MEN1 (0.62) | NPC1RAB9ACASP3SENP8SENP7 | |
| SCHEMBL11488934 | 0.70 | MEN1 (0.62) | NPC1RAB9ACASP3SENP8SENP7 | |
| SCHEMBL6422572 | 0.70 | TSHR (0.71) | NPC1RAB9ACASP3SENP8SENP7 | |
| SCHEMBL29585365 | 0.70 | RAB9A (0.40) | NPC1RAB9AALPLTP53HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-117143019-A | As beta 2 Pyrazole amide derivatives of allosteric antagonists of the adrenergic receptors | 常州大学 | 2023-12-01 | — | — | CN | disclosed |