Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL720559 | 0.74 | ALDH1A1 (0.42) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| Hydrochloric Acid SCHEMBL3154489 | 0.72 | ALDH1A1 (0.41) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| SCHEMBL3081411 | 0.71 | ALDH1A1 (0.38) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| SCHEMBL9211141 | 0.71 | ALDH1A1 (0.47) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| Thioxanthene SCHEMBL27774542 | 0.69 | ALDH1A1 (0.59) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| SCHEMBL10463774 | 0.68 | ALDH1A1 (0.64) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| SCHEMBL1498003 | 0.68 | ALDH1A1 (0.59) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| SCHEMBL27272787 | 0.68 | ALDH1A1 (0.37) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| SCHEMBL1868060 | 0.68 | ALDH1A1 (0.36) | ALDH1A1HPGDKDM4ECYP1A2MEN1 | |
| SCHEMBL11708484 | 0.68 | HPGD (0.37) | ALDH1A1HPGDKDM4ECYP1A2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001074771-A1 | PYRROLE-2,5-DIONE DERIVATIVES FOR THE TREATMENT OF DIABETES | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-10-11 | — | — | WO | disclosed |
| US-4545806-A | 5-(Oxo or thio heterocycle) cyclohexane-1,3-dione derivatives and their use for controlling undesirable plant growth | BASF AKTIENGESELLSCHAFT (DE) | 1985-10-08 | — | — | US | disclosed |
| EP-0120448-A1 | Derivatives of cyclohexane-1,3-dione, methods for their preparation and their use in combating non desired plants | BASF Aktiengesellschaft (DE) | 1984-10-03 | — | — | EP | disclosed |