Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.55 |
| ▸ | IDO1 | P14902 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.50 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.50 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.48 |
| ▸ | BCHE | P06276 | 2/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.44 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | F9 | P00740 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4779293 | 0.93 | ABCB1 (0.62) | ABCB1IDO1L3MBTL1MEN1KMT2A | |
| SCHEMBL29036345 | 0.84 | IDO1 (0.55) | ABCB1IDO1L3MBTL1MEN1KMT2A | |
| SCHEMBL10690676 | 0.81 | L3MBTL1 (0.65) | L3MBTL1MEN1KMT2APARP14PARP10 | |
| SCHEMBL15033480 | 0.81 | NPC1 (0.57) | ABCB1IDO1L3MBTL1MEN1KMT2A | |
| SCHEMBL920917 | 0.79 | IDO1 (0.53) | ABCB1IDO1L3MBTL1MEN1KMT2A | |
| SCHEMBL15033567 | 0.79 | IDO1 (0.58) | ABCB1IDO1L3MBTL1PARP14PARP10 | |
| SCHEMBL28624844 | 0.79 | ALDH1A1 (0.53) | ABCB1IDO1L3MBTL1MEN1KMT2A | |
| SCHEMBL3759217 | 0.79 | ENPP2 (0.50) | ABCB1IDO1L3MBTL1MEN1KMT2A | |
| SCHEMBL6857028 | 0.79 | L3MBTL1 (0.62) | ABCB1L3MBTL1MEN1KMT2APARP14 | |
| SCHEMBL14163906 | 0.78 | ABCB1 (0.54) | ABCB1IDO1L3MBTL1MEN1KMT2A |
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 |