Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | WEE1 | P30291 | 5/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | CMA1 | P23946 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.32 |
| ▸ | TERT | O14746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16100006 | 0.84 | ADORA3 (0.41) | ADORA3ADORA2ACYP2D6KDM5AHASPIN | |
| SCHEMBL16097995 | 0.84 | CYP2D6 (0.38) | ADORA3ADORA2ACYP2D6WEE1HTR2A | |
| SCHEMBL16099514 | 0.83 | DYRK1A (0.49) | ADORA3ADORA2ACYP2D6HTR2AHTR2C | |
| SCHEMBL16099174 | 0.82 | HASPIN (0.55) | ADORA3ADORA2ACYP2D6KDM5AHASPIN | |
| SCHEMBL16099273 | 0.81 | ADORA3 (0.40) | ADORA3ADORA2ADYRK1AKDM5AROCK2 | |
| SCHEMBL16099658 | 0.79 | NFATC1 (0.43) | ADORA3ADORA2AWEE1DYRK1ACHEK1 | |
| SCHEMBL16093943 | 0.77 | NFATC1 (0.47) | ADORA3ADORA2ACYP2D6WEE1DYRK1A | |
| SCHEMBL8172390 | 0.73 | CYP2D6 (0.70) | CYP2D6TDP2TDP1TERT | |
| SCHEMBL16099752 | 0.72 | HASPIN (0.47) | ADORA3ADORA2ACYP2D6HTR2AHTR2C | |
| SCHEMBL16100067 | 0.71 | ADORA3 (0.36) | ADORA3ADORA2ADYRK1AKDM5ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2968284-A2 | ALKYL-AMINE HARMINE DERIVATIVES FOR PROMOTING BONE GROWTH | Osteoqc Inc. (CA) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014153203-A2 | ALKYL-AMINE HARMINE DERIVATIVES FOR PROMOTING BONE GROWTH | OSSIFI INC. (US) | 2014-09-25 | — | — | WO | disclosed |