Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 13/20 | 0.61 |
| ▸ | MAOA | P21397 | 9/20 | 0.61 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.58 |
| ▸ | RXRA | P19793 | 1/20 | 0.52 |
| ▸ | RXRB | P28702 | 1/20 | 0.52 |
| ▸ | RXRG | P48443 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 1/20 | 0.50 |
| ▸ | AGXT | P21549 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL23989 | 0.85 | MAOB (0.60) | MAOBMAOANR4A2RXRARXRB | |
| SCHEMBL22316 | 0.83 | MAOB (0.66) | MAOBMAOANR4A2 | |
| SCHEMBL791896 | 0.82 | MAOB (0.70) | MAOBMAOANR4A2 | |
| SCHEMBL11959143 | 0.81 | MAOB (0.72) | MAOBMAOANR4A2RXRARXRB | |
| SCHEMBL22875 | 0.81 | MAOB (0.68) | MAOBIDO1AGXT | |
| SCHEMBL4698486 | 0.80 | NR4A2 (0.66) | MAOBMAOANR4A2RXRARXRB | |
| SCHEMBL21407 | 0.79 | RXRA (0.66) | MAOBMAOANR4A2RXRARXRB | |
| SCHEMBL12030885 | 0.79 | NR4A2 (0.64) | MAOBMAOANR4A2RXRARXRB | |
| SCHEMBL10269391 | 0.79 | MAOB (0.64) | MAOBMAOANR4A2RXRARXRB | |
| SCHEMBL12269278 | 0.79 | NR4A2 (0.60) | MAOBMAOANR4A2RXRARXRB |
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-2609089-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2013-07-03 | — | — | EP | disclosed |
| WO-2012025638-A1 | SELECTIVE 17BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS | Universität des Saarlandes (DE) | 2012-03-01 | — | — | WO | disclosed |