Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | PLG | P00747 | 5/20 | 0.48 |
| ▸ | KLK1 | P06870 | 4/20 | 0.48 |
| ▸ | KLK6 | Q92876 | 4/20 | 0.48 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.47 |
| ▸ | PLAU | P00749 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PLAT | P00750 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27822571 | 0.86 | CFD (0.55) | NPC1RAB9AKMT2A | |
| SCHEMBL1857575 | 0.83 | PTPN1 (0.65) | NPC1RAB9APLGKLK1KLK6 | |
| SCHEMBL6511264 | 0.82 | NPC1 (0.59) | NPC1RAB9ATSHRKDM4EMEN1 | |
| SCHEMBL27822579 | 0.81 | PLG (0.44) | PLGKLK1KLK6KLKB1PLAU | |
| Hydrochloric Acid SCHEMBL1160775 | 0.81 | PTPN1 (0.62) | NPC1RAB9APLGKLK1KLK6 | |
| SCHEMBL4317924 | 0.80 | PTPN11 (0.55) | PLGKLK1KLK6KLKB1PLAU | |
| SCHEMBL13885490 | 0.80 | CES2 (0.65) | RAB9ACYP1A2CYP2D6CYP2C9TSHR | |
| SCHEMBL545945 | 0.79 | SMN1; SMN2 (0.65) | NPC1RAB9ATSHRMEN1KMT2A | |
| SCHEMBL27822577 | 0.77 | CES2 (0.62) | NPC1RAB9ATSHRMEN1KMT2A | |
| SCHEMBL27841702 | 0.77 | MAOA (0.61) | NPC1RAB9AMEN1KMT2ACES2 |
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-102153433-B | N-monosubstituted-alpha-carbonylamide compound and preparation method thereof | UNIV SHANGHAI | 2013-09-04 | — | — | CN | disclosed |
| CN-102153433-A | N-monosubstituted-alpha-carbonylamide compound and preparation method thereof | UNIV SHANGHAI | 2011-08-17 | — | — | CN | disclosed |