Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FLT1 | P17948 | 1/20 | 0.51 |
| ▸ | KDR | P35968 | 1/20 | 0.51 |
| ▸ | TEK | Q02763 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RXRA | P19793 | 2/20 | 0.47 |
| ▸ | RXRB | P28702 | 2/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8913214 | 1.00 | FLT1 (0.51) | FLT1KDRTEKKDM4ECYP3A4 | |
| Hydrochloric Acid SCHEMBL8913289 | 0.98 | FLT1 (0.50) | FLT1KDRTEKKDM4ECYP3A4 | |
| Hydrochloric Acid SCHEMBL8913294 | 0.98 | FLT1 (0.50) | FLT1KDRTEKKDM4ECYP3A4 | |
| Hydrochloric Acid SCHEMBL8914887 | 0.98 | FLT1 (0.50) | FLT1KDRTEKKDM4ECYP3A4 | |
| SCHEMBL4103303 | 0.78 | KDM4E (0.55) | FLT1KDRTEKKDM4ECYP3A4 | |
| SCHEMBL6290983 | 0.77 | FLT1 (0.61) | FLT1KDRTEKKDM4ECYP3A4 | |
| SCHEMBL8912165 | 0.75 | ALDH1A1 (0.44) | FLT1KDRTEKMAPTNPSR1 | |
| SCHEMBL6295052 | 0.74 | FLT1 (0.66) | FLT1KDRTEKKDM4ECYP3A4 | |
| SCHEMBL4774594 | 0.73 | FLT1 (0.57) | FLT1KDRTEKKDM4ECYP3A4 | |
| SCHEMBL4774600 | 0.73 | FLT1 (0.57) | FLT1KDRTEKKDM4ECYP3A4 |
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 |