Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | THRA | P10827 | 3/20 | 0.45 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | RARB | P10826 | 3/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9398802 | 1.00 | THRB (0.50) | THRBMAPTSMN1; SMN2TP53THRA | |
| SCHEMBL9398281 | 0.94 | SMN1; SMN2 (0.53) | THRBMAPTSMN1; SMN2THRANPC1 | |
| SCHEMBL9398283 | 0.94 | SMN1; SMN2 (0.53) | THRBMAPTSMN1; SMN2THRANPC1 | |
| SCHEMBL9398677 | 0.92 | MAPT (0.51) | THRBMAPTSMN1; SMN2THRANPC1 | |
| SCHEMBL9398685 | 0.92 | MAPT (0.51) | THRBMAPTSMN1; SMN2THRANPC1 | |
| SCHEMBL9398781 | 0.90 | MAPT (0.49) | THRBMAPTSMN1; SMN2THRANPC1 | |
| SCHEMBL9398774 | 0.90 | MAPT (0.49) | THRBMAPTSMN1; SMN2THRANPC1 | |
| SCHEMBL4063436 | 0.89 | THRB (0.59) | THRBMAPTSMN1; SMN2TP53THRA | |
| SCHEMBL9588950 | 0.89 | LMNA (0.53) | THRBMAPTSMN1; SMN2THRANPC1 | |
| SCHEMBL9398657 | 0.89 | SMN1; SMN2 (0.48) | THRBMAPTSMN1; SMN2THRANPC1 |
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-5346647-A | Cyclohexane compounds used in liquid crystalline mixtures | HOFFMANN-LA ROCHE INC. (US) | 1994-09-13 | — | — | US | disclosed |