Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 2/20 | 0.60 |
| ▸ | MAOB | P27338 | 6/20 | 0.58 |
| ▸ | APP | P05067 | 2/20 | 0.58 |
| ▸ | BCHE | P06276 | 1/20 | 0.55 |
| ▸ | MAOA | P21397 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.53 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.51 |
| ▸ | RXRA | P19793 | 1/20 | 0.50 |
| ▸ | RXRB | P28702 | 1/20 | 0.50 |
| ▸ | RXRG | P48443 | 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 | |
|---|---|---|---|---|
| SCHEMBL5441069 | 0.92 | MAOB (0.66) | NR4A2MAOBAPPBCHEMAOA | |
| Benzylphenylether SCHEMBL22314 | 0.86 | LMNA (0.69) | NR4A2MAOBAPPBCHEMAOA | |
| SCHEMBL11857425 | 0.85 | MAOB (0.62) | NR4A2MAOBAPPBCHEMAOA | |
| SCHEMBL197223 | 0.84 | LMNA (0.67) | NR4A2MAOBAPPBCHEMAOA | |
| SCHEMBL10991891 | 0.82 | MAOB (0.80) | NR4A2MAOBAPPBCHEMAOA | |
| SCHEMBL850999 | 0.82 | APP (0.78) | NR4A2MAOBAPPBCHEMAOA | |
| SCHEMBL11846870 | 0.81 | BCHE (0.63) | NR4A2MAOBAPPBCHEMAOA | |
| SCHEMBL21407 | 0.81 | RXRA (0.66) | NR4A2MAOBMAOACYP1A2CYP2C19 | |
| SCHEMBL22562 | 0.80 | NPC1 (0.63) | MAOBAPPBCHELMNACYP1A2 | |
| SCHEMBL11600066 | 0.79 | MAOB (0.69) | NR4A2MAOBAPPMAOALMNA |
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 |