Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14590805 | 0.85 | ABL1 (0.45) | GAAALDH1A1TSHRNFKB1TDP1 | |
| SCHEMBL3229106 | 0.85 | ALDH1A1 (0.48) | GAAALDH1A1TSHRNFKB1TDP1 | |
| SCHEMBL14590807 | 0.83 | LMNA (0.46) | GAAALDH1A1TSHRNFKB1TDP1 | |
| SCHEMBL14590809 | 0.82 | ALDH1A1 (0.36) | GAAALDH1A1NFKB1TDP1ABL1 | |
| SCHEMBL14590803 | 0.82 | ABL1 (0.42) | GAAALDH1A1TSHRNFKB1TDP1 | |
| SCHEMBL14590802 | 0.81 | LMNA (0.44) | GAAALDH1A1TSHRNFKB1TDP1 | |
| SCHEMBL12303968 | 0.80 | CYP3A4 (0.56) | GAAALDH1A1TSHRNFKB1TDP1 | |
| SCHEMBL13634603 | 0.80 | GAA (0.68) | GAAALDH1A1TSHRNFKB1TDP1 | |
| SCHEMBL14590808 | 0.75 | SMN1; SMN2 (0.43) | GAAALDH1A1NFKB1MAPTLMNA | |
| SCHEMBL12797853 | 0.75 | PTGS2 (0.54) | GAAALDH1A1TSHRMAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-7166738-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-01-23 | — | — | US | disclosed |