Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFATC1 | O95644 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.38 |
| ▸ | WEE1 | P30291 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16093943 | 0.95 | NFATC1 (0.47) | NFATC1GSK3BDYRK1AADORA3ADORA2A | |
| SCHEMBL16099754 | 0.85 | HASPIN (0.45) | NFATC1GSK3BDYRK1AMAOAMAOB | |
| SCHEMBL16099686 | 0.84 | NFATC1 (0.41) | NFATC1GSK3BDYRK1ACHEK1WEE1 | |
| SCHEMBL16100067 | 0.83 | ADORA3 (0.36) | NFATC1GSK3BDYRK1AADORA3ADORA2A | |
| SCHEMBL16098684 | 0.81 | MAOA (0.39) | MAOAMAOBCHEK1WEE1LMNA | |
| SCHEMBL16099021 | 0.80 | HASPIN (0.47) | NFATC1GSK3BDYRK1AMAOAMAOB | |
| SCHEMBL16098699 | 0.79 | ADORA3 (0.44) | DYRK1AADORA3ADORA2ACHEK1WEE1 | |
| SCHEMBL16099174 | 0.78 | HASPIN (0.55) | ADORA3ADORA2AMAOAMAOBTSHR | |
| SCHEMBL16100006 | 0.76 | ADORA3 (0.41) | ADORA3ADORA2AMAOAMAOB | |
| SCHEMBL16099755 | 0.73 | HASPIN (0.44) | NFATC1GSK3BDYRK1AMAOALMNA |
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 |