Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | NCF1 | P14598 | 5/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 6/20 | 0.44 |
| ▸ | HTR5A | P47898 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6080507 | 0.99 | KDM4E (0.46) | KDM4ENCF1ADRB2ADRB1HTR6 | |
| SCHEMBL6604563 | 0.87 | KDM4E (0.46) | KDM4ENCF1KMT2AHSD17B10ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6079350 | 0.86 | KDM4E (0.44) | KDM4ENCF1KMT2AHSD17B10ALDH1A1 | |
| SCHEMBL6080136 | 0.86 | KDM4E (0.48) | KDM4ENCF1ADRB2ADRB1HTR6 | |
| SCHEMBL6591671 | 0.85 | KDM4A (0.48) | KDM4ENCF1HTR6KMT2AALDH1A1 | |
| SCHEMBL6599066 | 0.85 | PIK3CA (0.52) | NCF1 | |
| SCHEMBL6596699 | 0.85 | HTR5A (0.47) | KDM4ENCF1ADRB2ADRB1HTR6 | |
| Hydrochloric Acid SCHEMBL6079161 | 0.84 | KDM4E (0.48) | KDM4ENCF1ADRB2ADRB1HTR6 | |
| Hydrochloric Acid SCHEMBL6079508 | 0.84 | KDM4A (0.47) | KDM4ENCF1HTR6KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL6079756 | 0.80 | LATS1 (0.41) | KDM4EKMT2AHTR2AHTR3AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1451159-A1 | COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF | NEURO3D (FR) | 2004-09-01 | — | — | EP | claimed |
| WO-2003010146-A1 | COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF | NEURO3D (FR) | 2003-02-06 | — | — | WO | claimed |
| EP-1451159-A1 | COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF | NEURO3D (FR) | 2004-09-01 | — | — | EP | disclosed |
| WO-2003010146-A1 | COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF | NEURO3D (FR) | 2003-02-06 | — | — | WO | disclosed |