Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9870320 | 1.00 | ALDH1A1 (0.56) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10556115 | 0.81 | CYP1A2 (0.65) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10556110 | 0.81 | CYP1A2 (0.65) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL728234 | 0.78 | TSHR (0.53) | MAPTCYP1A2CYP3A4CYP2C19KMT2A | |
| SCHEMBL726466 | 0.78 | TSHR (0.53) | MAPTCYP1A2CYP3A4CYP2C19KMT2A | |
| SCHEMBL9193565 | 0.77 | TSHR (0.55) | MAPTKMT2AHTTTSHRNPC1 | |
| SCHEMBL3012426 | 0.76 | MAPT (0.56) | MAPTKMT2ATSHRNPC1RAB9A | |
| SCHEMBL10558030 | 0.75 | ALDH1A1 (0.77) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL10558036 | 0.75 | ALDH1A1 (0.77) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL14069230 | 0.75 | CYP1A2 (0.67) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C19 |
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-5037980-A | Anxiolytic agents, hypotensive agents | AMERICAN CYANAMID COMPANY (US) | 1991-08-06 | — | — | US | disclosed |