Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | NPC1 | O15118 | 6/20 | 0.38 |
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9343927 | 0.89 | NPC1 (0.49) | ALDH1A1NPC1RAB9ASMN1; SMN2CYP2C19 | |
| SCHEMBL9348049 | 0.83 | SMN1; SMN2 (0.38) | ALDH1A1NPC1RAB9ASMN1; SMN2CYP2C19 | |
| SCHEMBL111353 | 0.78 | ALDH1A1 (0.47) | ALDH1A1NPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL6565906 | 0.73 | ALDH1A1 (0.41) | ALDH1A1NPC1RAB9ASMN1; SMN2ALOX15 | |
| SCHEMBL4992463 | 0.70 | ALDH1A1 (0.39) | ALDH1A1NPC1RAB9ASMN1; SMN2ALOX15 | |
| SCHEMBL10948510 | 0.70 | ALDH1A1 (0.49) | ALDH1A1NPC1RAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL3893410 | 0.68 | ALDH1A1 (0.40) | ALDH1A1NPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL8671709 | 0.68 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL1350898 | 0.67 | TNKS (0.40) | CYP1A2HTTLMNA | |
| SCHEMBL18075602 | 0.66 | PYCR1 (0.41) | CYP1A2HTTLMNA |
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-5342546-A | Liquid crystal compositions | L.C.C. CONSULTANTS CO., LTD. (JP) | 1994-08-30 | — | — | US | disclosed |