Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | PTGES | O14684 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL10522678 | 0.84 | ALDH1A1 (0.48) | GAAMAPK1TSHRCYP3A4ALDH1A1 | |
| Heptane SCHEMBL11601626 | 0.82 | KDM4A (0.47) | GAAMAPK1TSHRALDH1A1RAB9A | |
| SCHEMBL28150293 | 0.78 | NPC1 (0.40) | GAALTA4HMAPK1TSHRCYP3A4 | |
| Benzene SCHEMBL28190998 | 0.78 | GBA1 (0.46) | TSHRCYP3A4TP53ALDH1A1MAPT | |
| SCHEMBL28157389 | 0.77 | NPC1 (0.42) | GAALTA4HMAPK1TSHRCYP3A4 | |
| 1,2-Dichlorobenzene SCHEMBL16500053 | 0.76 | TSHR (0.46) | LTA4HMAPK1TSHRCYP3A4TP53 | |
| Propanol SCHEMBL28293061 | 0.74 | HPGD (0.47) | MAPK1TSHRCYP3A4TP53ALDH1A1 | |
| Dodecylamine SCHEMBL8912929 | 0.74 | DNM1 (0.50) | TSHRALDH1A1RAB9ANPC1MEN1 | |
| SCHEMBL28337807 | 0.74 | LTA4H (0.46) | LTA4HMAPK1TSHRCYP3A4TP53 | |
| Hydrogen Sulfide SCHEMBL28173631 | 0.74 | NPC1 (0.45) | GAALTA4HMAPK1TSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1608689-A1 | REMOVAL OF THIOCARBONYL END GROUPS OF POLYMERS | Symyx Technologies, Inc. (US) | 2005-12-28 | — | — | EP | disclosed |
| US-6919409-B2 | Removal of the thiocarbonylthio or thiophosphorylthio end group of polymers and further functionalization thereof | SYMYX TECHNOLOGIES, INC. (US) | 2005-07-19 | — | — | US | disclosed |
| US-20040266953-A1 | Removal of the thiocarbonylthio or thiophosphorylthio end group of polymers and further functionalization thereof | SYMYX TECHNOLOGIES, INC. | 2004-12-30 | — | — | US | disclosed |
| WO-2004089994-A1 | REMOVAL OF THIOCARBONYL END GROUPS OF POLYMERS | SYMYX TECHNOLOGIES, INC. (US) | 2004-10-21 | — | — | WO | disclosed |