Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGIR | P43119 | 1/20 | 0.60 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | CHKA | P35790 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | TACR1 | P25103 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.51 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.51 |
| ▸ | CMA1 | P23946 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8107629 | 0.94 | SIGMAR1 (0.65) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA | |
| SCHEMBL1586605 | 0.94 | SIGMAR1 (0.65) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA | |
| SCHEMBL5023610 | 0.85 | HRH3 (0.72) | HRH3SIGMAR1ABCB1 | |
| SCHEMBL22469256 | 0.85 | PTGIR (0.60) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA | |
| SCHEMBL9829472 | 0.84 | ABCB1 (0.57) | PTGIRSIGMAR1SMN1; SMN2GAATACR1 | |
| SCHEMBL3171551 | 0.84 | PTGIR (0.81) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA | |
| SCHEMBL1045927 | 0.84 | PTGIR (0.75) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA | |
| SCHEMBL28048490 | 0.84 | PTGIR (0.75) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA | |
| Hydrochloric Acid SCHEMBL23850638 | 0.82 | PTGIR (0.73) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA | |
| SCHEMBL1890751 | 0.82 | PTGIR (0.78) | PTGIRHRH3SIGMAR1SMN1; SMN2CHKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009058810-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED 2,4,5,6,7,8-HEXAHYDRO-1,2,6-TRIAZA-AZULENE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-05-07 | — | — | WO | disclosed |
| WO-2009058810-A1 | PROCESS FOR THE PREPARATION OF SUBSTITUTED 2,4,5,6,7,8-HEXAHYDRO-1,2,6-TRIAZA-AZULENE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-05-07 | — | — | WO | disclosed |