Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | DHFR | P00374 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | BCR | P11274 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12323364 | 1.00 | MAPT (0.49) | MAPTSMN1; SMN2ALDH1A1DHFRCYP2D6 | |
| SCHEMBL12323363 | 0.79 | SMN1; SMN2 (0.35) | SMN1; SMN2GSK3BABL1BCR | |
| SCHEMBL12324580 | 0.79 | SMN1; SMN2 (0.35) | SMN1; SMN2GSK3BABL1BCR | |
| SCHEMBL12323366 | 0.77 | MAPT (0.50) | MAPTSMN1; SMN2ALDH1A1CYP2D6GSK3B | |
| SCHEMBL12323371 | 0.77 | NR1H2 (0.40) | SMN1; SMN2CYP2D6KMT2ANPC1 | |
| SCHEMBL2340384 | 0.77 | ALDH1A1 (0.41) | MAPTSMN1; SMN2ALDH1A1TSHRGAA | |
| SCHEMBL2340390 | 0.77 | ALDH1A1 (0.41) | MAPTSMN1; SMN2ALDH1A1TSHRGAA | |
| SCHEMBL2050138 | 0.76 | BRD4 (0.40) | MAPTSMN1; SMN2ALDH1A1TSHRKMT2A | |
| SCHEMBL2050140 | 0.76 | BRD4 (0.40) | MAPTSMN1; SMN2ALDH1A1TSHRKMT2A | |
| SCHEMBL12323370 | 0.75 | KRAS (0.37) | SMN1; SMN2ABL1BCR |
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-2011113293-A1 | DIHYDROPTERIDINONE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 江苏恒瑞医药股份有限公司 (CN) | 2011-09-22 | — | — | WO | disclosed |