Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 6/20 | 0.40 |
| ▸ | RAB9A | P51151 | 6/20 | 0.40 |
| ▸ | HTT | P42858 | 5/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | GALR3 | O60755 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 1/20 | 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 | |
|---|---|---|---|---|
| Octane SCHEMBL28253594 | 1.00 | TSHR (0.47) | TSHRTHRBTBXAS1NPC1RAB9A | |
| Heptane SCHEMBL28254518 | 1.00 | TSHR (0.47) | TSHRTHRBTBXAS1NPC1RAB9A | |
| Heptane SCHEMBL28253586 | 1.00 | TSHR (0.47) | TSHRTHRBTBXAS1NPC1RAB9A | |
| Hexane SCHEMBL28254499 | 0.97 | TSHR (0.41) | TSHRTHRBTBXAS1NPC1RAB9A | |
| Pentane SCHEMBL28253628 | 0.91 | LMNA (0.44) | TSHRTHRBTBXAS1NPC1RAB9A | |
| Butane SCHEMBL28253617 | 0.84 | INMT (0.32) | — | |
| Butane SCHEMBL21632359 | 0.84 | INMT (0.32) | — | |
| SCHEMBL28172904 | 0.82 | TSHR (0.64) | TSHRMGLLALDH1A1 | |
| SCHEMBL1792913 | 0.78 | NPC1 (0.57) | TSHRTHRBTBXAS1NPC1RAB9A | |
| Fluoride SCHEMBL18438900 | 0.78 | NPC1 (0.54) | TBXAS1NPC1RAB9AHTTMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109806910-A | A kind of molecular sieve carried high-dispersion metal catalyst of H-type EUO and preparation method thereof | 中触媒新材料股份有限公司 | 2019-05-28 | — | — | CN | claimed |
| CN-109046444-A | A kind of bifunctional catalyst and preparation method thereof of C8 aromatics isomerization | 中触媒新材料股份有限公司 | 2018-12-21 | — | — | CN | claimed |
| CN-108862314-A | One kind is with multi-stage porous and wide silica alumina ratio EUO structure molecular screen and synthetic method | 中触媒新材料股份有限公司 | 2018-11-23 | — | — | CN | claimed |
| CN-109806910-A | A kind of molecular sieve carried high-dispersion metal catalyst of H-type EUO and preparation method thereof | 中触媒新材料股份有限公司 | 2019-05-28 | — | — | CN | disclosed |