Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | GSR | P00390 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11744877 | 1.00 | ALDH1A1 (0.53) | ALDH1A1TSHRTRPA1HDAC1HDAC8 | |
| SCHEMBL6332502 | 0.79 | TRPA1 (0.52) | ALDH1A1TRPA1HDAC1HDAC8HDAC6 | |
| SCHEMBL6332503 | 0.79 | TRPA1 (0.52) | ALDH1A1TRPA1HDAC1HDAC8HDAC6 | |
| SCHEMBL5030176 | 0.79 | ALDH1A1 (0.57) | ALDH1A1TSHRCA1CA2MEN1 | |
| SCHEMBL14198039 | 0.79 | TRPA1 (0.55) | ALDH1A1TSHRTRPA1HDAC1HDAC8 | |
| SCHEMBL13589808 | 0.78 | TRIM24 (0.56) | ALDH1A1TSHRTRPA1CA1CA2 | |
| SCHEMBL28280107 | 0.78 | ALDH1A1 (0.56) | ALDH1A1TSHRMEN1KMT2ALMNA | |
| SCHEMBL28830141 | 0.78 | TRIM24 (0.56) | ALDH1A1TSHRTRPA1CA1CA2 | |
| SCHEMBL2074913 | 0.77 | GABRA1 (0.57) | ALDH1A1TSHRLMNAHPGDNPSR1 | |
| SCHEMBL2074915 | 0.77 | GABRA1 (0.57) | ALDH1A1TSHRLMNAHPGDNPSR1 |
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-4009170-A | 1-Ethoxy-3,4-dihydroisoquindines | STERLING DRUG INC. (US) | 1977-02-22 | — | — | US | disclosed |