Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4225554 | 0.78 | CA12 (0.53) | PYCR1ALDH1A1LMNANPC1RAB9A | |
| SCHEMBL6195289 | 0.76 | ALDH1A1 (0.44) | GAAALDH1A1SMN1; SMN2TDP1PTGS2 | |
| SCHEMBL3260825 | 0.71 | LMNA (0.57) | GAAALDH1A1TDP1PTGS2LMNA | |
| Hydrochloric Acid SCHEMBL10514498 | 0.68 | MEN1 (0.46) | GAAALDH1A1SMN1; SMN2LMNANPC1 | |
| SCHEMBL9524582 | 0.68 | ALDH1A1 (0.45) | GAAALDH1A1SMN1; SMN2TDP1PTGS2 | |
| SCHEMBL1758402 | 0.67 | ALDH1A1 (0.46) | GAAALDH1A1SMN1; SMN2TDP1PTGS2 | |
| SCHEMBL989796 | 0.67 | TAAR1 (0.55) | SMN1; SMN2LMNANPC1RAB9AMAPT | |
| SCHEMBL28682890 | 0.67 | PYCR1 (0.66) | PYCR1GAAALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL28688578 | 0.66 | CYP3A4 (0.53) | ALDH1A1SMN1; SMN2LMNANPC1RAB9A | |
| SCHEMBL28787570 | 0.66 | PTGS2 (0.60) | GAAALDH1A1SMN1; SMN2TDP1PTGS2 |
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-2280968-A2 | PYRIDO [3, 4-B]INDOLES AND METHODS OF USE | Medivation Technologies, Inc. (US) | 2011-02-09 | — | — | EP | disclosed |
| WO-2009120717-A2 | PYRIDO [3, 4-B] INDOLES AND METHODS OF USE | MEDIVATION TECHNOLOGIES, INC. (US) | 2009-10-01 | — | — | WO | disclosed |