Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 4/20 | 0.42 |
| ▸ | GSK3A | P49840 | 3/20 | 0.40 |
| ▸ | GSK3B | P49841 | 3/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 4/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4967709 | 0.81 | MGLL (0.47) | MGLLGSK3AGSK3BFAAHALDH1A1 | |
| SCHEMBL2720410 | 0.73 | MGLL (0.75) | MGLLGSK3AGSK3BFAAHALDH1A1 | |
| SCHEMBL10072540 | 0.73 | MGLL (0.75) | MGLLGSK3AGSK3BFAAHALDH1A1 | |
| SCHEMBL15503283 | 0.73 | MGLL (0.75) | MGLLGSK3AGSK3BFAAHALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL18261569 | 0.72 | MGLL (0.59) | MGLLGSK3AGSK3BAKT1FAAH | |
| SCHEMBL5143542 | 0.72 | MGLL (0.71) | MGLLGSK3AGSK3BFAAHALDH1A1 | |
| SCHEMBL18157046 | 0.71 | PTGS1 (0.62) | MGLLGSK3AGSK3BFAAHALDH1A1 | |
| SCHEMBL15206463 | 0.71 | MGLL (0.56) | MGLLGSK3AGSK3BFAAHALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL3420976 | 0.71 | MGLL (0.56) | MGLLGSK3AGSK3BAKT1FAAH | |
| Trifluoroacetic Acid SCHEMBL20677193 | 0.71 | PTGS1 (0.44) | MGLLFAAHALDH1A1MAPTDRD2 |
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-1585791-A1 | HYDROPHILIC, THIOL-REACTIVE CYANINE DYES AND CONJUGATES THEREOF WITH BIOMOLECULES FOR FLUORESCENCE DIAGNOSIS | Schering AG (DE) | 2005-10-19 | — | — | EP | disclosed |
| WO-2004065491-A1 | HYDROPHILIC, THIOL-REACTIVE CYANINE DYES AND CONJUGATES THEREOF WITH BIOMOLECULES FOR FLUORESCENCE DIAGNOSIS | SCHERING AG (DE) | 2004-08-05 | — | — | WO | disclosed |