Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 2/20 | 0.37 |
| ▸ | ACACA | Q13085 | 1/20 | 0.37 |
| ▸ | LPL | P06858 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18201985 | 0.79 | THRB (0.40) | THRBACACBACACANPC1ALDH1A1 | |
| SCHEMBL8990318 | 0.78 | L3MBTL1 (0.43) | ALDH1A1MAPTKMT2APPARGPPARA | |
| SCHEMBL3126542 | 0.76 | ACHE (0.46) | THRBCA2ACACBACACALPL | |
| SCHEMBL3711064 | 0.74 | ACACB (0.43) | THRBCA2ACACBACACALPL | |
| SCHEMBL13308116 | 0.74 | ACACB (0.43) | THRBCA2ACACBACACALPL | |
| SCHEMBL4574183 | 0.73 | THRB (0.41) | THRBCA2ACACBACACALPL | |
| SCHEMBL4573831 | 0.73 | CA2 (0.44) | THRBCA2ACACBACACALPL | |
| SCHEMBL3126539 | 0.71 | ALDH1A1 (0.41) | THRBCA2LPLLIPGMGLL | |
| SCHEMBL15115432 | 0.70 | ACACB (0.40) | THRBCA2ACACBACACALPL | |
| SCHEMBL9570671 | 0.69 | THRB (0.38) | THRBCA2ACACBACACALPL |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998008837-A1 | PHENYLBUTANOL DERIVATIVES, METHODS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF | FARMACON, INC. (US) | 1998-03-05 | — | — | WO | disclosed |