Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 7/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.37 |
| ▸ | THRA | P10827 | 5/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16603415 | 0.87 | MAOA (0.46) | MAOAMAOBTHRBCYP4A11THRA | |
| SCHEMBL9482558 | 0.86 | ALDH1A1 (0.36) | L3MBTL1ALDH1A1THRBCYP4A11THRA | |
| SCHEMBL9256719 | 0.86 | THRB (0.45) | L3MBTL1ALDH1A1MAOBTHRBCYP4A11 | |
| SCHEMBL8052185 | 0.83 | L3MBTL1 (0.35) | L3MBTL1ALDH1A1THRBCYP4A11THRA | |
| SCHEMBL9303397 | 0.83 | KMT2A (0.47) | L3MBTL1ALDH1A1MAOAMAOBTHRB | |
| SCHEMBL9253512 | 0.82 | ALDH1A1 (0.49) | L3MBTL1ALDH1A1MAOAMAOBMEN1 | |
| SCHEMBL8913584 | 0.81 | THRB (0.58) | L3MBTL1ALDH1A1THRBCYP4A11THRA | |
| SCHEMBL8923657 | 0.81 | THRB (0.58) | THRBTHRAMEN1KMT2ACYP3A4 | |
| SCHEMBL9303970 | 0.81 | MAPT (0.53) | ALDH1A1THRBCYP4A11CYP4F2KMT2A | |
| SCHEMBL9256549 | 0.80 | ADRB2 (0.45) | MAOAMAOBPTPN1MAPTSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5454974-A | Halobenzene liquid crystals | HOFFMANN-LA ROCHE INC. (US) | 1995-10-03 | — | — | US | disclosed |
| US-5302317-A | Halobenzene liquid crystals | HOFFMANN-LA ROCHE INC. (US) | 1994-04-12 | — | — | US | disclosed |
| US-5230826-A | HALOBENZENE LIQUID CRYSTALS | HOFFMANN-LA ROCHE INC. (US) | 1993-07-27 | — | — | US | disclosed |