Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 7/20 | 0.40 |
| ▸ | KLKB1 | P03952 | 7/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.37 |
| ▸ | WDR5 | P61964 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8866066 | 0.86 | GCGR (0.40) | — | |
| Trifluoroacetic Acid SCHEMBL9233799 | 0.85 | HDAC4 (0.38) | F10CHRM3 | |
| Trifluoroacetic Acid SCHEMBL8866264 | 0.83 | F11 (0.39) | F11KLKB1DPP4DPP7WDR5 | |
| SCHEMBL8866031 | 0.79 | HRH3 (0.42) | WDR5PDE10A | |
| Trifluoroacetic Acid SCHEMBL8867001 | 0.77 | DPP4 (0.37) | F11KLKB1DPP4DPP7WDR5 | |
| SCHEMBL8866085 | 0.76 | ACACB (0.54) | KDM4E | |
| Trifluoroacetic Acid SCHEMBL8867403 | 0.73 | MAPT (0.43) | LMNA | |
| SCHEMBL8866091 | 0.71 | WDR5 (0.40) | DPP4DPP7WDR5ALDH1A1KDM4E | |
| SCHEMBL14561629 | 0.70 | WDR5 (0.41) | WDR5ALDH1A1KDM4ENPC1LMNA | |
| Trifluoroacetic Acid SCHEMBL8866962 | 0.68 | ALDH1A1 (0.50) | ALDH1A1KDM4ENPC1RAB9AHPGDS |
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 |