Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 12/20 | 0.38 |
| ▸ | PGK1 | P00558 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CNOT7 | Q9UIV1 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1388094 | 0.82 | YTHDC1 (0.40) | TLR7PGK1PPARGKDM4EALDH1A1 | |
| SCHEMBL6155362 | 0.81 | NPC1 (0.40) | ALDH1A1NPC1TP53MAPTHTT | |
| Hydrochloric Acid SCHEMBL7031630 | 0.81 | YTHDC1 (0.39) | TLR7PGK1PPARGKDM4EALDH1A1 | |
| SCHEMBL1387987 | 0.81 | SRC (0.41) | KDM4EALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL1387909 | 0.80 | KCNH2 (0.39) | PPARGNPC1MAPTHTTRAB9A | |
| SCHEMBL7372968 | 0.79 | ALDH1A1 (0.38) | KDM4EALDH1A1TP53HPGDKMT2A | |
| SCHEMBL7378986 | 0.78 | YTHDC1 (0.45) | KDM4EALDH1A1HTTSMN1; SMN2HTR2A | |
| SCHEMBL7740554 | 0.77 | CTSL (0.32) | — | |
| SCHEMBL7379035 | 0.77 | CTSL (0.41) | KDM4EALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL7380275 | 0.75 | BUB1 (0.33) | ALDH1A1 |
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-6294541-B1 | ENZYME INHIBITORS USING PURINE COMPOUNDS AS ANTIHISTAMINES | EURO-CELTIQUE S.A. (LU) | 2001-09-25 | — | — | US | disclosed |