Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.33 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL4788776 | 0.79 | IDH1 (0.36) | TSHRRXFP1IDO1DCUN1D1 | |
| SCHEMBL4790016 | 0.79 | CYP2A6 (0.35) | ALDH1A1HSD17B10TSHRKMT2AKDM4E | |
| Hydrochloric Acid SCHEMBL7766719 | 0.79 | HTR7 (0.36) | ALDH1A1GAATSHRMEN1KMT2A | |
| SCHEMBL4789469 | 0.79 | ALDH1A1 (0.35) | ALDH1A1GAATSHRGID4KDM4E | |
| SCHEMBL5115977 | 0.76 | HSD11B1 (0.38) | HSD17B10TSHRMEN1KMT2AHTR2A | |
| SCHEMBL8784998 | 0.75 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1HSD17B10GAANOS2 | |
| SCHEMBL120894 | 0.74 | SIGMAR1 (0.47) | HTR2AHTR2C | |
| SCHEMBL4789473 | 0.73 | TDP1 (0.44) | ALDH1A1L3MBTL1HSD17B10GAAKMT2A | |
| SCHEMBL6595415 | 0.69 | ADRA2A (0.40) | HTR2A | |
| SCHEMBL7408443 | 0.69 | KDM4E (0.36) | ALDH1A1GAATSHRUSP2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1945024-A4 | IN VIVO FLUORESCENCE IMAGING | AGENCY SCIENCE TECH & RES (SG) | 2008-12-17 | — | — | EP | disclosed |
| EP-1945024-A1 | IN VIVO FLUORESCENCE IMAGING | Agency for Science, Technology and Research (SG) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007046774-A1 | IN VIVO FLUORESCENCE IMAGING | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2007-04-26 | — | — | WO | disclosed |