Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14236838 | 0.99 | TSHR (0.58) | TSHRPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL844601 | 0.94 | TSHR (0.63) | TSHRPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19174812 | 0.90 | ALDH1A1 (0.58) | TSHRPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL12443203 | 0.88 | LMNA (0.62) | TSHRPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3542244 | 0.87 | LMNA (0.63) | TSHRPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL240523 | 0.83 | TSHR (0.63) | TSHRPOLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1726864 | 0.82 | HCAR3 (0.64) | POLBNPC1RAB9ASMN1; SMN2CYP1A2 | |
| SCHEMBL28079589 | 0.81 | ALDH1A1 (0.70) | POLBNPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL1725095 | 0.81 | HCAR3 (0.80) | POLBSMN1; SMN2LMNAALDH1A1MAPT | |
| SCHEMBL1724823 | 0.81 | POLB (0.59) | POLBNPC1RAB9ASMN1; SMN2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-105801582-A | Novel dihydro pteridinone derivative, preparing method thereof and application to medicine | 合肥工业大学 | 2016-07-27 | — | — | CN | disclosed |