Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.41 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.38 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16544662 | 0.90 | CYP11B1 (0.41) | CYP11B1CYP11B2L3MBTL1GAAALDH1A1 | |
| SCHEMBL16810784 | 0.85 | KDM4E (0.45) | HPGDRAB9ASMN1; SMN2MAPTCYP11B1 | |
| SCHEMBL31314477 | 0.81 | AHR (0.44) | NPC1RAB9ASMN1; SMN2CYP11B1CYP11B2 | |
| SCHEMBL20689786 | 0.77 | TSHR (0.55) | NPC1HPGDTSHRRAB9ASMN1; SMN2 | |
| SCHEMBL13326628 | 0.77 | CYP11B1 (0.34) | CYP11B1CYP11B2L3MBTL1ALDH1A1 | |
| SCHEMBL18542354 | 0.76 | CA12 (0.40) | L3MBTL1GAAALDH1A1 | |
| SCHEMBL16810643 | 0.76 | CA12 (0.40) | L3MBTL1GAAALDH1A1 | |
| SCHEMBL16810785 | 0.76 | KDM4E (0.45) | HPGDRAB9ASMN1; SMN2MAPTL3MBTL1 | |
| SCHEMBL9927344 | 0.75 | NISCH (0.36) | TSHRPOLBMAPTALDH1A1 | |
| SCHEMBL200730 | 0.75 | ACHE (0.58) | NPC1HPGDTSHRRAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3101088-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2017-11-29 | — | — | EP | disclosed |