Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.60 |
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | CA12 | O43570 | 4/20 | 0.58 |
| ▸ | CA1 | P00915 | 4/20 | 0.58 |
| ▸ | CA6 | P23280 | 4/20 | 0.58 |
| ▸ | CA7 | P43166 | 4/20 | 0.58 |
| ▸ | CA9 | Q16790 | 4/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.58 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.58 |
| ▸ | MAOB | P27338 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | CA2 | P00918 | 3/20 | 0.58 |
| ▸ | CA5A | P35218 | 3/20 | 0.58 |
| ▸ | CA4 | P22748 | 3/20 | 0.58 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.58 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.58 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.58 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL25203866 | 0.86 | GPR35 (0.63) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL25697521 | 0.80 | MAOA (0.53) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL11266285 | 0.75 | MAOA (0.71) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL29785071 | 0.75 | MAOA (1.00) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL979779 | 0.75 | MAOA (1.00) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL17893712 | 0.74 | ALDH1A1 (0.70) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL9068782 | 0.74 | KDM4E (1.00) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL980099 | 0.74 | MAOA (0.69) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL9068774 | 0.74 | MAOA (0.69) | MAOAGPR35ALDH1A1CA12CA1 | |
| SCHEMBL31315658 | 0.74 | MAOA (0.69) | MAOAGPR35ALDH1A1CA12CA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012019106-A2 | POSITIVE AND NEGATIVE MODULATORS OF NMDA RECEPTORS | BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) | 2012-02-09 | — | — | WO | disclosed |