Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 11/20 | 0.52 |
| ▸ | MAOB | P27338 | 11/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16562212 | 0.80 | MEN1 (0.64) | MAOAMAOBCA12CA1CA2 | |
| SCHEMBL29092205 | 0.77 | MAOB (0.80) | MAOAMAOBCA12CA1CA2 | |
| SCHEMBL29966607 | 0.77 | MAOB (0.80) | MAOAMAOBCA12CA1CA2 | |
| SCHEMBL10518875 | 0.70 | DRD2 (0.63) | MAOB | |
| SCHEMBL16554123 | 0.70 | MAOB (0.64) | MAOAMAOBALDH1A1 | |
| SCHEMBL10519865 | 0.69 | KDM4E (0.60) | MAOAMAOBCA12CA1CA2 | |
| SCHEMBL10517295 | 0.69 | DRD2 (0.67) | — | |
| SCHEMBL7373528 | 0.68 | KDM4E (0.62) | MAOAMAOBCA12CA1CA2 | |
| SCHEMBL28776653 | 0.68 | KDM4E (0.62) | MAOAMAOBCA12CA1CA2 | |
| SCHEMBL17916754 | 0.68 | GRM4 (0.46) | CA12KDM4ECA9MEN1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3041470-A1 | METHODS AND COMPOSITIONS FOR SELECTIVE AND TARGETED CANCER THERAPY | Board Of Regents Of the University Of Texas System (US) | 2016-07-13 | — | — | EP | disclosed |
| WO-2015035051-A1 | METHODS AND COMPOSITIONS FOR SELECTIVE AND TARGETED CANCER THERAPY | BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2015-03-12 | — | — | WO | disclosed |