Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.46 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28250048 | 0.95 | RAB9A (0.51) | NPC1RAB9AP2RX1TRPV1KCNK3 | |
| SCHEMBL5311319 | 0.91 | KIF11 (0.51) | NPC1RAB9ATRPV1HDAC2PTGS1 | |
| SCHEMBL28250190 | 0.90 | POLB (0.54) | NPC1RAB9APOLBGPR132HDAC2 | |
| SCHEMBL28250050 | 0.88 | KCNK3 (0.55) | NPC1RAB9AP2RX1POLBKCNK3 | |
| SCHEMBL28250847 | 0.85 | NPC1 (0.53) | NPC1RAB9APOLBGPR132LMNA | |
| SCHEMBL28536704 | 0.85 | CTDSP1 (0.53) | NPC1RAB9APOLBGPR132LMNA | |
| SCHEMBL28528461 | 0.84 | POLB (0.50) | NPC1RAB9APOLBGPR132MAPT | |
| SCHEMBL28250845 | 0.84 | TRPV1 (0.52) | NPC1RAB9APOLBTRPV1GPR132 | |
| SCHEMBL28908852 | 0.79 | POLB (0.53) | NPC1RAB9APOLBGPR132LMNA | |
| SCHEMBL839896 | 0.79 | RAB9A (0.50) | NPC1RAB9AP2RX1TRPV1KCNK3 |
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-108752232-B | Synthetic method of alpha-quaternary carbon amino acid | 四川大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-108752232-A | A kind of synthetic method of α-quaternary carbon amino acid | 四川大学 | 2018-11-06 | — | — | CN | disclosed |