Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | NOS3 | P29474 | 2/20 | 0.48 |
| ▸ | NOS1 | P29475 | 2/20 | 0.48 |
| ▸ | NOS2 | P35228 | 2/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | XIAP | P98170 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29785614 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1NOS3NOS1 | |
| SCHEMBL7885274 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1NOS3NOS1 | |
| SCHEMBL30013379 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1NOS3NOS1 | |
| SCHEMBL7386862 | 0.88 | NOS3 (0.46) | ALDH1A1KMT2AMEN1NOS3NOS1 | |
| SCHEMBL5991851 | 0.87 | ALDH1A1 (0.49) | ALDH1A1KMT2AMEN1HIF1AATM | |
| SCHEMBL2675352 | 0.86 | KDM4E (0.48) | ALDH1A1KMT2AMEN1NOS3NOS1 | |
| SCHEMBL2675348 | 0.86 | KDM4E (0.48) | ALDH1A1KMT2AMEN1NOS3NOS1 | |
| SCHEMBL490857 | 0.86 | ALDH1A1 (0.53) | ALDH1A1KMT2AMEN1HIF1AATM | |
| SCHEMBL155234 | 0.86 | NOS3 (0.55) | ALDH1A1KMT2AMEN1NOS3NOS1 | |
| SCHEMBL155235 | 0.86 | NOS3 (0.55) | ALDH1A1KMT2AMEN1NOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995023603-A1 | USE OF 2-AMINO-4,5,7,8-TETRAHYDRO-6H-THIAZOLO[5,4-D]AZEPINES SUBSTITUTED IN POSITION 6 AS MEDICAMENTS HAVING AN ANTI-DEPRESSANT EFFECT, AND PREPARATION THEREOF | DR. KARL THOMAE GMBH (DE) | 1995-09-08 | — | — | WO | claimed |