Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CETP | P11597 | 3/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | RARA | P10276 | 3/20 | 0.38 |
| ▸ | RARG | P13631 | 3/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.37 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12813449 | 0.84 | RARB (0.41) | CES2CES1RARBHPGDTSHR | |
| SCHEMBL12813347 | 0.84 | ALDH1A1 (0.47) | SRD5A2CES2CES1RARBHPGD | |
| SCHEMBL12813157 | 0.83 | NPC1 (0.40) | RARBMEN1KMT2AEPHX2 | |
| SCHEMBL12813465 | 0.81 | RARB (0.43) | RARBRARARARGRXRA | |
| SCHEMBL12813293 | 0.79 | RARB (0.41) | RARBMEN1HPGDTSHRKMT2A | |
| SCHEMBL12813339 | 0.78 | RARB (0.42) | CES2CES1RARBMEN1KMT2A | |
| SCHEMBL16499394 | 0.78 | RARB (0.47) | RARBRARARARGRXRA | |
| SCHEMBL12813501 | 0.77 | HTT (0.45) | CES2CES1RARBRARARARG | |
| SCHEMBL8034537 | 0.77 | CYP1A2 (0.49) | RARBMEN1TSHRKMT2ARARA | |
| SCHEMBL16499346 | 0.75 | EPHX2 (0.40) | RARBRARARARGRXRAEPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012134971-A2 | OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE | BIKAM PHARMACEUTICALS, INC. (US) | 2012-10-04 | — | — | WO | disclosed |
| WO-2011155983-A1 | OPSIN-BINDING LIGANDS, COMPOSITIONS AND METHODS OF USE | BIKAM PHARMACEUTICALS INC. (US) | 2011-12-15 | — | — | WO | disclosed |