Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15775397 | 0.82 | ACHE (0.40) | ALDH1A1AXLMAPTSMN1; SMN2RAB9A | |
| SCHEMBL15775400 | 0.79 | CYP2D6 (0.47) | CYP2D6CYP2C19 | |
| SCHEMBL15775298 | 0.79 | ALDH1A1 (0.38) | ALDH1A1AXLMAPTSMN1; SMN2RAB9A | |
| SCHEMBL15775665 | 0.79 | ALDH1A1 (0.40) | ALDH1A1AXLMAPTSMN1; SMN2RAB9A | |
| SCHEMBL15775346 | 0.78 | ACHE (0.43) | ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E | |
| SCHEMBL15775583 | 0.74 | TDP1 (0.49) | ALDH1A1MAPTSMN1; SMN2RAB9AHSD17B10 | |
| SCHEMBL15775398 | 0.72 | RAB9A (0.40) | ALDH1A1CD274MAPTSMN1; SMN2RAB9A | |
| SCHEMBL15775566 | 0.71 | KCNH2 (0.35) | ALDH1A1SMN1; SMN2RAB9AKDM4ECYP1A2 | |
| SCHEMBL15775238 | 0.71 | PARP10 (0.39) | CDK5CDK5R1 | |
| Bromide SCHEMBL15775273 | 0.70 | MAOA (0.35) | ALDH1A1MAPTPTGER1PTGER4PTGER3 |
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-2014087165-A1 | TANKYRASE INHIBITORS | UNIVERSITY OF BATH (GB) | 2014-06-12 | — | — | WO | disclosed |