Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | NAT1 | P18440 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | SCN4A | P35499 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7236829 | 1.00 | ALDH1A1 (0.45) | ALDH1A1MMP2MMP9NAT1CA2 | |
| SCHEMBL8090986 | 0.81 | ALDH1A1 (0.40) | ALDH1A1MMP2MMP9NAT1CA2 | |
| SCHEMBL7243423 | 0.75 | CYP2C19 (0.50) | TSHRLMNAMEN1KMT2AFAAH | |
| SCHEMBL3299636 | 0.70 | ALDH1A1 (0.47) | ALDH1A1MMP2MMP9GAACACNA1F | |
| SCHEMBL14077803 | 0.67 | ALDH1A1 (0.40) | ALDH1A1MMP2MMP9GAAHTT | |
| SCHEMBL4237258 | 0.67 | ALDH1A1 (0.56) | ALDH1A1MMP2MMP9GAAHTT | |
| SCHEMBL542865 | 0.66 | ALDH1A1 (0.59) | ALDH1A1MMP2MMP9CACNA1FMAPT | |
| SCHEMBL4384462 | 0.66 | ALDH1A1 (0.59) | ALDH1A1MMP2MMP9CACNA1FMAPT | |
| SCHEMBL4384456 | 0.66 | ALDH1A1 (0.59) | ALDH1A1MMP2MMP9CACNA1FMAPT | |
| SCHEMBL7481341 | 0.65 | CNR1 (0.55) | ALDH1A1GAAMAPTTP53TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6320057-B1 | REACTING 2-THIOTHIAZOLIDINE-5-ONES WITH AN OPTIONALLY ACYLATED ARYL- OR HETEROARYL-HYDRAZINE | RHONE POULENC AGRO (FR) | 2001-11-20 | — | — | US | disclosed |
| EP-0915858-B1 | INTERMEDIATES FOR THE PREPARATION OF 2-IMIDAZOLINE-5-ONES | AVENTIS CROPSCIENCE SA (FR) | 2000-09-13 | — | — | EP | disclosed |
| EP-0915858-A1 | INTERMEDIATES FOR THE PREPARATION OF 2-IMIDAZOLINE-5-ONES | Rhone Poulenc Agro (FR) | 1999-05-19 | — | — | EP | disclosed |
| WO-1998003490-A1 | INTERMEDIATES FOR THE PREPARATION OF 2-IMIDAZOLINE-5-ONES | RHONE POULENC AGRO (FR) | 1998-01-29 | — | — | WO | disclosed |