Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | QPCT | Q16769 | 1/20 | 0.42 |
| ▸ | TACR3 | P29371 | 1/20 | 0.42 |
| ▸ | CCR3 | P51677 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | TEK | Q02763 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8912165 | 1.00 | ALDH1A1 (0.44) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL8912159 | 0.76 | ALDH1A1 (0.44) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL8913214 | 0.75 | FLT1 (0.51) | ALDH1A1HTTSMN1; SMN2FLT1KDR | |
| Hydrochloric Acid SCHEMBL8914887 | 0.74 | FLT1 (0.50) | ALDH1A1HTTSMN1; SMN2FLT1KDR | |
| Hydrochloric Acid SCHEMBL8913289 | 0.74 | FLT1 (0.50) | ALDH1A1HTTSMN1; SMN2FLT1KDR | |
| SCHEMBL24157992 | 0.71 | ALDH1A1 (0.58) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL28202339 | 0.70 | ALDH1A1 (0.60) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL8912900 | 0.68 | ALDH1A1 (0.42) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL8912912 | 0.68 | ALDH1A1 (0.42) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 | |
| SCHEMBL9716965 | 0.68 | CNR2 (0.49) | ALDH1A1HTTNCOA1SMN1; SMN2NCOA3 |
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-5606073-A | INTERMEDIATES FOR ADENOSINE ANTAGONISTS | EISAI CO., LTD. (JP) | 1997-02-25 | — | — | US | disclosed |
| US-5541213-A | ADENOSINE A1 RECEPTOR ANTAGONISTS, TREATMENT OF KIDNEY DISORDERS | EISAI CO., LTD. (JP) | 1996-07-30 | — | — | US | disclosed |
| EP-0630894-A1 | Propenoic acid derivatives as adenosine A1 antagonists | Eisai Co., Ltd. (JP) | 1994-12-28 | — | — | EP | disclosed |