Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ECE1 | P42892 | 1/20 | 0.34 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.33 |
| ▸ | TUBB | P07437 | 2/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.33 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.33 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.33 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.33 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.33 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.33 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28038176 | 0.75 | PLAT (0.36) | PDE10AHPGD | |
| SCHEMBL16003631 | 0.74 | PDE10A (0.44) | ALDH1A1PDE10AKDM4EHPGDECE1 | |
| SCHEMBL28038156 | 0.73 | PDE10A (0.37) | HSD17B10PDE10AKDM4EECE1CHEK2 | |
| SCHEMBL27996912 | 0.72 | BACE1 (0.46) | RAB9AADORA2AADORA1ADORA3 | |
| SCHEMBL21233278 | 0.72 | CYP11B2 (0.40) | ALDH1A1RAB9APDE10AKDM4EHPGD | |
| SCHEMBL16352268 | 0.71 | PDE10A (0.42) | ALDH1A1PDE10AKDM4EHPGDGABRA1 | |
| SCHEMBL27996600 | 0.70 | LPAR1 (0.42) | ALDH1A1RAB9AKDM4EHPGD | |
| SCHEMBL31441776 | 0.69 | RAB9A (0.39) | ALDH1A1RAB9AHSD17B10ECE1SMPD3 | |
| SCHEMBL28042898 | 0.68 | P2RX7 (0.32) | — | |
| SCHEMBL22951301 | 0.68 | ADORA2A (0.37) | RAB9APDE10AKDM4EHPGDSMPD3 |
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-105189493-A | Novel Pyrazole Derivatives | MOCHIDA PHARM CO LTD | 2015-12-23 | — | — | CN | disclosed |