Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADCY1 | Q08828 | 12/20 | 0.74 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.74 |
| ▸ | SLC2A1 | P11166 | 4/20 | 0.74 |
| ▸ | TSHR | P16473 | 3/20 | 0.74 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.74 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.74 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.74 |
| ▸ | GMNN | O75496 | 1/20 | 0.74 |
| ▸ | BLM | P54132 | 1/20 | 0.74 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.74 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.74 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.74 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.74 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.74 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.74 |
| ▸ | HTR1A | P08908 | 1/20 | 0.74 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.74 |
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 SCHEMBL10918873 | 0.99 | ADCY1 (0.73) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| Hydrochloric Acid SCHEMBL9737827 | 0.99 | ADCY1 (0.73) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| Hydrochloric Acid SCHEMBL9631021 | 0.94 | ADCY1 (0.68) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| SCHEMBL10920392 | 0.91 | ADCY1 (0.77) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| SCHEMBL9832447 | 0.91 | ADCY1 (0.77) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| Hydrochloric Acid SCHEMBL10919777 | 0.90 | ADCY1 (0.75) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| Hydrochloric Acid SCHEMBL9739813 | 0.90 | ADCY1 (0.75) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| SCHEMBL10699874 | 0.89 | ADCY1 (0.79) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| SCHEMBL10730498 | 0.89 | ADCY1 (0.71) | ADCY1MAPK1CYP3A4SLC2A1TSHR | |
| Hydrochloric Acid SCHEMBL10765074 | 0.89 | ADCY1 (0.69) | ADCY1MAPK1CYP3A4SLC2A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0193132-B1 | LABDAN-DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-04-17 | — | — | EP | claimed |
| US-4771049-A | REDUCING INTRAOCULAR PRESSURE | HOECHST-ROUSSEL PHARMACEUTICALS (US) | 1988-09-13 | — | — | US | claimed |
| US-4677103-A | REDUCING INTRAOCULAR PRESSURE | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1987-06-30 | — | — | US | disclosed |