Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.42 |
| ▸ | FLT1 | P17948 | 1/20 | 0.42 |
| ▸ | FLT4 | P35916 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | ITGAV | P06756 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8707463 | 0.81 | CYP2C19 (0.48) | ALDH1A1HTTNR3C2GAATSHR | |
| SCHEMBL14676017 | 0.78 | SLC1A3 (0.49) | ALDH1A1POLBSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL22648418 | 0.76 | PARG (0.50) | ALDH1A1POLBFLT1FLT4KDR | |
| SCHEMBL3583413 | 0.72 | NSD2 (0.50) | ALDH1A1POLBSLC1A3SLC1A2SLC1A1 | |
| SCHEMBL878148 | 0.72 | ALDH1A1 (0.38) | ALDH1A1POLBHTT | |
| SCHEMBL22710652 | 0.71 | HTT (0.45) | ALDH1A1HTTGAATSHRHSD17B10 | |
| SCHEMBL1969478 | 0.71 | LMNA (0.45) | ALDH1A1GAA | |
| SCHEMBL26920833 | 0.71 | FFAR4 (0.46) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL26920776 | 0.71 | FFAR4 (0.46) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL14306296 | 0.71 | KCNN4 (0.43) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 |
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-3142655-B1 | COMPOSITIONS AND METHODS OF TREATING CARDIAC FIBROSIS WITH IFETROBAN | CUMBERLAND PHARMACEUTICALS INC (US) | 2020-12-02 | — | — | EP | disclosed |
| US-5840330-A | GRANULATING ACTIVE SUBSTANCE AND SUBSTANCE WHICH COMPENSATES FOR SELF-RETARDATION PROPERTIES, COMPRESSING WITH RELEASE-RETARDING AGENT SUCH THAT GRANULATE FORMS INNER PHASE AND RETARDANT OUTER PHASE | BOEHRINGER MANNHELM GMBH (DE) | 1998-11-24 | — | — | US | disclosed |