Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 3/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.54 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.54 |
| ▸ | DRD1 | P21728 | 2/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.54 |
| ▸ | HTR2B | P41595 | 2/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27666357 | 0.99 | KDM4E (0.55) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| SCHEMBL27597677 | 0.89 | ABCB11 (0.56) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| Hydrochloric Acid SCHEMBL6635562 | 0.88 | MAPK1 (0.57) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| SCHEMBL6500655 | 0.76 | ABCB11 (0.61) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| SCHEMBL10623034 | 0.75 | DRD3 (0.59) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| Hydrochloric Acid SCHEMBL3172892 | 0.75 | ABCB11 (0.60) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| SCHEMBL10620348 | 0.74 | ABCB11 (0.57) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| Hydrochloric Acid SCHEMBL6659698 | 0.73 | NPSR1 (0.45) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| Hydrochloric Acid SCHEMBL6659697 | 0.73 | CYP2C19 (0.48) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 | |
| SCHEMBL28763592 | 0.72 | ABCB11 (0.55) | ABCB11CYP2C19ADRA2ACYP2B6DRD1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100404539-C | Process for preparing amorphous form of a medicament - blood platelet coagulation inhibitor | EGIS GYEGYSZERGYAR RT (HU) | 2008-07-23 | — | — | CN | disclosed |
| CN-1812994-A | Process for preparing amorphous form of a medicament - blood platelet coagulation inhibitor | EGIS GYEGYSZERGYAR RT (HU) | 2006-08-02 | — | — | CN | disclosed |