Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | DCTPP1 | Q9H773 | 3/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.31 |
| ▸ | RAB9A | P51151 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL17058531 | 0.91 | ALDH1A1 (0.34) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058247 | 0.85 | ALDH1A1 (0.34) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058586 | 0.85 | SMN1; SMN2 (0.35) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058235 | 0.82 | DCTPP1 (0.36) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058119 | 0.80 | SMN1; SMN2 (0.41) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058589 | 0.80 | ALDH1A1 (0.37) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058213 | 0.79 | LIN28A (0.33) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058168 | 0.79 | MAPT (0.40) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058526 | 0.77 | LIN28A (0.34) | ALDH1A1DCTPP1RXFP1NPC1RAB9A | |
| SCHEMBL17058238 | 0.77 | SMN1; SMN2 (0.35) | ALDH1A1DCTPP1RXFP1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2137179-B1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | MERCK SHARP & DOHME (US) | 2015-09-02 | — | — | EP | disclosed |