Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.38 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9229587 | 0.88 | DHODH (0.40) | DHODHSMN1; SMN2ALDH1A1ALDH1A2ALDH1A3 | |
| Trifluoroacetic Acid SCHEMBL8866393 | 0.84 | ITGB3 (0.45) | DHODHSMN1; SMN2ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL8866928 | 0.82 | THRB (0.42) | SMN1; SMN2ALDH1A1ALDH1A3THRBLMNA | |
| SCHEMBL8866447 | 0.82 | SUV39H2 (0.46) | SMN1; SMN2THRBLMNAABL1RIN1 | |
| SCHEMBL8866605 | 0.81 | THRB (0.42) | SMN1; SMN2ALDH1A1ALDH1A3THRBKDM4E | |
| SCHEMBL8866849 | 0.80 | SUV39H2 (0.44) | ALDH1A1THRBTP53ACACBACACA | |
| Trifluoroacetic Acid SCHEMBL9232906 | 0.80 | HTR2A (0.42) | DHODHSMN1; SMN2ALDH1A1ALDH1A2ALDH1A3 | |
| SCHEMBL8866171 | 0.76 | THRB (0.42) | SMN1; SMN2ALDH1A1ALDH1A3THRBKDM4E | |
| SCHEMBL8866874 | 0.75 | SUV39H2 (0.44) | ALDH1A1THRBTSHRABL1RIN1 | |
| SCHEMBL8865927 | 0.74 | DHODH (0.43) | DHODHALDH1A1ALDH1A2ALDH1A3KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5614531-A | Adhesion receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-03-25 | — | — | US | disclosed |