Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 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 | |
|---|---|---|---|---|
| SCHEMBL36821 | 0.84 | — | — | |
| SCHEMBL10033490 | 0.83 | TSHR (0.42) | THRBTSHRALDH1A1HTT | |
| SCHEMBL711490 | 0.83 | THRB (0.53) | THRBTSHRALDH1A1GAAHTT | |
| SCHEMBL29958613 | 0.82 | CYP4F2 (0.44) | THRBTSHRALDH1A1PKMKDM4E | |
| Methane SCHEMBL21632462 | 0.82 | CYP4F2 (0.44) | THRBTSHRALDH1A1PKMKDM4E | |
| Chloromethane SCHEMBL17453350 | 0.82 | THRB (0.59) | THRBTSHRALDH1A1MAPTGLO1 | |
| SCHEMBL19409375 | 0.82 | THRB (0.64) | THRBTSHRALDH1A1MAPTGLO1 | |
| SCHEMBL15030 | 0.82 | — | — | |
| Tert-Butylamine SCHEMBL463083 | 0.80 | THRB (0.53) | THRBTSHRALDH1A1MAPTGLO1 | |
| SCHEMBL12319771 | 0.80 | TSHR (0.53) | THRBTSHRALDH1A1GAAHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1745012-A2 | COMPOSITIONS OF ALLOSTERIC HEMOGLOBIN MODIFIERS AND METHODS OF MAKING THE SAME | Allos Therapeutics, Inc. (US) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005102305-A2 | COMPOSITIONS OF ALLOSTERIC HEMOGLOBIN MODIFIERS AND METHODS OF MAKING THE SAME | ALLOS THERAPEUTICS, INC. (US) | 2005-11-03 | — | — | WO | disclosed |