Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL299909 | 0.85 | ALDH1A1 (0.54) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL994480 | 0.84 | ALDH1A1 (0.49) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL12932112 | 0.83 | ALDH1A1 (0.48) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL21240 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL291947 | 0.81 | ALDH1A1 (0.57) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL21239 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL12932150 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL291949 | 0.80 | ALDH1A1 (0.56) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL4067427 | 0.80 | ALDH1A1 (0.56) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 | |
| SCHEMBL291948 | 0.80 | ALDH1A1 (0.56) | ALDH1A1CYP1A2TSHRTDP1SMN1; SMN2 |
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-2427573-A2 | METHOD OF OLIGONUCLEOTIDE LABELING USING CYCLOADDITION REACTION | Chemgenes Corporation (US) | 2012-03-14 | — | — | EP | claimed |
| WO-2010129656-A2 | METHOD OF OLIGONUCLEOTIDE LABELING USING CYCLOADDITION REACTION | CHEMGENES CORPORATION (US) | 2010-11-11 | — | — | WO | claimed |