Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLL | Q9UGP5 | 1/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 7/20 | 0.50 |
| ▸ | DRD2 | P14416 | 5/20 | 0.50 |
| ▸ | DRD3 | P35462 | 5/20 | 0.50 |
| ▸ | DRD4 | P21917 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | HTR5A | P47898 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1508668 | 1.00 | POLL (0.62) | POLLCYP19A1HSD11B1HTR1ADRD2 | |
| SCHEMBL2818908 | 0.90 | POLL (0.55) | POLLCYP19A1HSD11B1KMT2ACA1 | |
| SCHEMBL24510645 | 0.81 | S1PR1 (0.52) | POLLHTR1ADRD2DRD3DRD4 | |
| SCHEMBL13518769 | 0.81 | POLL (0.47) | POLLCYP19A1HSD11B1HTR1ADRD2 | |
| SCHEMBL13616708 | 0.81 | POLL (0.49) | POLLDRD2ADRA1A | |
| SCHEMBL30715540 | 0.80 | CYP19A1 (0.48) | POLLCYP19A1HSD11B1HTR1ADRD2 | |
| SCHEMBL11087080 | 0.80 | ACHE (0.50) | POLLKMT2ATSHR | |
| SCHEMBL17014300 | 0.80 | HTR1A (0.55) | CYP19A1HSD11B1HTR1ADRD2DRD3 | |
| SCHEMBL29944713 | 0.79 | POLL (0.48) | POLLCYP19A1HSD11B1DRD2DRD3 | |
| SCHEMBL24873168 | 0.79 | CYP19A1 (0.50) | CYP19A1HSD11B1HTR1ADRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6750243-B1 | COMPETITIVE INHIBITORS OF TRYPSIN-LIKE SERINE PROTEASES, ESPECIALLY THROMBIN; chemical synthesis; anticoagulants; treatment of thrombosis | AstraZeneća AB (SE) | 2004-06-15 | — | — | US | claimed |