Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL133271 | 1.00 | SLC6A3 (0.39) | SLC6A3MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL27860935 | 0.72 | SLC6A3 (0.40) | SLC6A3KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL12530396 | 0.71 | TRPV1 (0.40) | MEN1KMT2AALDH1A1MAPTHSP90AA1 | |
| SCHEMBL4413580 | 0.70 | PTGS1 (0.60) | SLC6A3MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL5166757 | 0.69 | TRPV1 (0.44) | MEN1KMT2AALDH1A1MAPTHSP90AA1 | |
| SCHEMBL10333915 | 0.68 | PTGS1 (0.59) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL30967863 | 0.67 | SLC6A3 (0.51) | SLC6A3MEN1KMT2APTGS1PTGS2 | |
| SCHEMBL7004680 | 0.67 | SLC6A3 (0.51) | SLC6A3MEN1KMT2APTGS1PTGS2 | |
| SCHEMBL15012993 | 0.67 | TRPV1 (0.38) | MEN1KMT2AALDH1A1MAPTHSP90AA1 | |
| SCHEMBL8801783 | 0.64 | SLC6A3 (0.38) | SLC6A3CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |
| US-7851637-B2 | Compounds and methods for inhibiting the interaction of BCL proteins with binding partners | INFINITY PHARMACEUTICALS, INC. (US) | 2010-12-14 | — | — | US | disclosed |