Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 4/20 | 0.31 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 3/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | MMP12 | P39900 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9003677 | 0.80 | CYP2A6 (0.41) | CYP2A6MAPTTSHRHSD17B10CTBP2 | |
| SCHEMBL9003318 | 0.79 | TSHR (0.40) | CYP2A6MAPTTSHRHSD17B10CTBP2 | |
| SCHEMBL9003768 | 0.76 | CYP2A6 (0.37) | CYP2A6MAPTTSHRHSD17B10MAOB | |
| SCHEMBL9003603 | 0.74 | MAPT (0.41) | CYP2A6MAPTTSHRCTBP2MAOB | |
| SCHEMBL9003454 | 0.73 | — | — | |
| SCHEMBL309451 | 0.71 | LMNA (0.38) | CYP2A6TSHRLMNAMAOA | |
| Lithium Ion SCHEMBL9003568 | 0.69 | LMNA (0.37) | CYP2A6TSHRLMNAMAOA | |
| SCHEMBL8757782 | 0.68 | MAOA (0.34) | CYP2A6MAOBMAOACYP11B1CYP11B2 | |
| Tetramethylammonium Ion SCHEMBL1412797 | 0.68 | LMNA (0.35) | CYP2A6TSHRHSD17B10LMNAMAOA | |
| SCHEMBL9003483 | 0.67 | NSD2 (0.36) | MAPTMAOBMAOAKDM1ACYP11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5500453-A | INITIATOR FOR PHOTOSENSITIVE FREE RADICAL CURING/ POLYMERIZATION OF UNSATURATED COMPOUNDS | TOYO INK MANUFACTURING CO., LTD. (JP) | 1996-03-19 | — | — | US | disclosed |