Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.70 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.57 |
| ▸ | IDO1 | P14902 | 2/20 | 0.57 |
| ▸ | AGXT | P21549 | 2/20 | 0.57 |
| ▸ | BCHE | P06276 | 2/20 | 0.57 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.57 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.56 |
| ▸ | HTR1A | P08908 | 2/20 | 0.56 |
| ▸ | DRD2 | P14416 | 2/20 | 0.56 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL13263642 | 0.93 | MAOB (0.79) | MAOBMRGPRX4TP53PKMNFKB1 | |
| SCHEMBL23718 | 0.88 | MAOB (0.62) | MAOBMRGPRX4TP53PKMNFKB1 | |
| SCHEMBL14547318 | 0.86 | MAOB (0.81) | MAOBMRGPRX4TP53PKMNFKB1 | |
| SCHEMBL22562 | 0.83 | NPC1 (0.63) | MAOBRAB9ASMN1; SMN2BCHEFFAR1 | |
| SCHEMBL791569 | 0.82 | MAOB (1.00) | MAOBMRGPRX4BCHECYP4F2CYP4A11 | |
| Benzylphenylether SCHEMBL22314 | 0.82 | LMNA (0.69) | MAOBRAB9ASMN1; SMN2BCHECYP4F2 | |
| SCHEMBL3649253 | 0.81 | MRGPRX4 (0.76) | MAOBMRGPRX4TP53PKMNFKB1 | |
| SCHEMBL4697138 | 0.81 | MAOB (0.67) | MAOBMRGPRX4RAB9AIDO1AGXT | |
| SCHEMBL15730033 | 0.81 | MAOB (0.62) | MAOBMRGPRX4SMN1; SMN2IDO1AGXT | |
| SCHEMBL171916 | 0.81 | MAOB (0.73) | MAOBMRGPRX4TP53PKMNFKB1 |
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 |