Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | SCN1A | P35498 | 2/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27512823 | 0.98 | CYP1A2 (0.42) | ALDH1A1CYP1A2CYP2D6SCN1ASCN2A | |
| SCHEMBL7786466 | 0.95 | CYP1A2 (0.42) | ALDH1A1CYP1A2CYP2D6SCN1ASCN2A | |
| SCHEMBL7794808 | 0.95 | CYP1A2 (0.43) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL7792098 | 0.94 | ALDH1A1 (0.41) | ALDH1A1MAPTCHRNA7KMT2AADORA2A | |
| SCHEMBL7796463 | 0.93 | CYP1A2 (0.44) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL7796236 | 0.93 | TTR (0.40) | ALDH1A1MAPTCHRNA7KMT2AADORA2A | |
| Hydrochloric Acid SCHEMBL7786457 | 0.93 | ALDH1A1 (0.41) | ALDH1A1MAPTCHRNA7KMT2AADORA2A | |
| SCHEMBL7792181 | 0.92 | CYP1A2 (0.41) | CYP1A2CYP2D6SCN1ASCN2ASCN3A | |
| SCHEMBL7792216 | 0.92 | ALDH1A1 (0.41) | ALDH1A1TSHRMAPTCHRNA7KMT2A | |
| SCHEMBL7792470 | 0.91 | CYP1A2 (0.42) | ALDH1A1CYP1A2CYP2D6SCN1ASCN2A |
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-0906268-B1 | ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS | AVENTIS PHARMA INC (US) | 2001-11-28 | — | — | EP | disclosed |
| US-6004959-A | HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS | HOECHST MARION ROUSSEL, INC. (US) | 1999-12-21 | — | — | US | disclosed |