Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | HTT | P42858 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | MMP14 | P50281 | 1/20 | 0.42 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3402420 | 0.87 | ALDH1A1 (0.51) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL972533 | 0.83 | KDM4E (0.53) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL7994583 | 0.83 | PTGS2 (0.56) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL973305 | 0.82 | ALDH1A1 (0.55) | LMNAHTTGAAALDH1A1KDM4E | |
| SCHEMBL8736878 | 0.81 | SMN1; SMN2 (0.85) | SMN1; SMN2LMNAHTTGAAALDH1A1 | |
| SCHEMBL20988347 | 0.81 | IDO1 (0.63) | SMN1; SMN2LMNAHTTALDH1A1IDO1 | |
| SCHEMBL13876057 | 0.81 | LMNA (0.54) | SMN1; SMN2LMNAHTTALDH1A1IDO1 | |
| SCHEMBL10153980 | 0.81 | ADAMTS4 (0.62) | SMN1; SMN2LMNAHTTALDH1A1KDM4E | |
| Ammonia Solution, Strong SCHEMBL3402419 | 0.81 | ALDH1A1 (0.53) | LMNAHTTGAAALDH1A1KDM4E | |
| SCHEMBL8737052 | 0.79 | KDM4E (0.66) | SMN1; SMN2HTTGAAALDH1A1KDM4E |
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-2010005783-A1 | PYRROLIDINYL AND PIPERIDINYL COMPOUNDS USEFUL AS NHE-1 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-01-14 | — | — | WO | disclosed |