Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9879887 | 0.92 | SREBF2 (0.41) | RAB9ASMN1; SMN2NPC1XDHSLC22A12 | |
| SCHEMBL9824783 | 0.80 | LMNA (0.36) | RAB9ASMN1; SMN2NPC1XDHSLC22A12 | |
| SCHEMBL23555392 | 0.79 | CYP2A6 (0.42) | RAB9ASMN1; SMN2NPC1PTGS2CASP3 | |
| SCHEMBL9826641 | 0.78 | ACHE (0.38) | RAB9ASMN1; SMN2NPC1ALDH1A1TP53 | |
| SCHEMBL23555711 | 0.78 | CYP2A6 (0.41) | RAB9ASMN1; SMN2NPC1CA12CA2 | |
| SCHEMBL9825028 | 0.76 | XDH (0.38) | RAB9ASMN1; SMN2CA12CA2XDH | |
| SCHEMBL157640 | 0.71 | SMN1; SMN2 (0.42) | RAB9ASMN1; SMN2NPC1L3MBTL1KDM4E | |
| SCHEMBL23555362 | 0.71 | CA2 (0.64) | CA12CA2ESR1ESR2DYRK1A | |
| SCHEMBL18608518 | 0.71 | CA2 (0.64) | CA12CA2ESR1ESR2DYRK1A | |
| SCHEMBL9825192 | 0.69 | KDM4E (0.39) | RAB9ASMN1; SMN2NPC1CA12CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5037575-A | Photostability | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) | 1991-08-06 | — | — | US | disclosed |
| EP-0187015-B1 | SQUARILIUM COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME | MITSUBISHI KASEI CORPORATION (JP) | 1991-05-29 | — | — | EP | disclosed |