Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | PRKCH | P24723 | 1/20 | 0.33 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL10510673 | 0.89 | ADORA3 (0.44) | ADORA3ALDH1A1HSD17B10HIF1AL3MBTL1 | |
| SCHEMBL9218291 | 0.88 | NPC1 (0.42) | ADORA3L3MBTL1NPC1RAB9ACYP2A6 | |
| SCHEMBL31427619 | 0.82 | ALDH1A1 (0.37) | ADORA3ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL28328752 | 0.80 | L3MBTL1 (0.44) | ALDH1A1HSD17B10HIF1ACYP1B1HTR2A | |
| Bromide SCHEMBL5045247 | 0.79 | ALDH1A1 (0.34) | ADORA3ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL31427616 | 0.77 | ALDH1A1 (0.33) | ADORA3ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL637127 | 0.76 | ALDH1A1 (0.32) | ALDH1A1HSD17B10HIF1ACYP1B1HTR2A | |
| SCHEMBL638693 | 0.76 | TLR7 (0.38) | HSD17B10 | |
| SCHEMBL16008026 | 0.76 | CA1 (0.38) | ALDH1A1HSD17B10HIF1ACYP1B1HTR2A | |
| SCHEMBL242954 | 0.71 | PLAU (0.50) | ALDH1A1HSD17B10L3MBTL1PTPN1NPC1 |
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-5220012-A | Macropolycyclic rare earth complexes and application as fluorescent tracers | COMPAGNIE ORIS INDUSTRIE SA (FR) | 1993-06-15 | — | — | US | disclosed |
| EP-0180492-B1 | MACROPOLYCYCLIC COMPLEXES OF RARE EARTH METALS AND APPLICATION AS FLUORESCENT LABELS | CIS BIO INTERNATIONAL (FR) | 1993-06-02 | — | — | EP | disclosed |
| EP-0180492-A1 | Macropolycyclic complexes of rare earth metals and application as fluorescent labels | CIS BIO INTERNATIONAL (FR) | 1986-05-07 | — | — | EP | disclosed |