Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.32 |
| ▸ | ACACA | Q13085 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | HTR7 | P34969 | 2/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | GNA11 | P29992 | 1/20 | 0.30 |
| ▸ | GNAQ | P50148 | 1/20 | 0.30 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.30 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.30 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8866377 | 0.94 | ACACB (0.38) | ACACBACACAHRH3GPR119NPC1 | |
| SCHEMBL8867167 | 0.90 | ACACB (0.34) | ACACBACACAHRH3GPR119NPC1 | |
| SCHEMBL8865702 | 0.85 | GBA1 (0.42) | ACACBACACANPC1RAB9AHDAC6 | |
| SCHEMBL8866110 | 0.84 | ACACB (0.41) | ACACBACACAHRH3GPR119NPC1 | |
| SCHEMBL8867162 | 0.84 | ACACB (0.38) | ACACBACACAHRH3IRAK1 | |
| SCHEMBL8866062 | 0.82 | ACACB (0.43) | ACACBACACAGPR119IRAK1 | |
| SCHEMBL8866367 | 0.79 | ACACB (0.43) | ACACBACACAHDAC6 | |
| SCHEMBL8866833 | 0.79 | CA12 (0.38) | GPR119HDAC4HDAC6GNA11GNAQ | |
| SCHEMBL8866094 | 0.77 | ACACB (0.45) | ACACBACACAIRAK1 | |
| SCHEMBL8867512 | 0.76 | GBA1 (0.34) | NPC1RAB9AHDAC4HDAC6 |
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 |