Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | MMP14 | P50281 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.37 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11550510 | 0.87 | HAO1 (0.43) | ACACBMMP14FFAR1MMP2MMP3 | |
| SCHEMBL11550385 | 0.86 | MAPT (0.38) | NPC1RAB9AACACBMMP2MMP9 | |
| SCHEMBL11552067 | 0.85 | CYP2C9 (0.39) | NPC1POLBCYP2C9RAB9AFFAR1 | |
| SCHEMBL11552212 | 0.85 | AR (0.40) | NPC1POLBCYP2C9RAB9AMMP14 | |
| SCHEMBL11550786 | 0.80 | ESR2 (0.45) | FFAR1MAPTMGLL | |
| SCHEMBL11297332 | 0.80 | HTT (0.45) | NPC1POLBCYP2C9RAB9AFFAR1 | |
| SCHEMBL11556810 | 0.78 | MAPT (0.38) | NPC1RAB9AHAO1MAPT | |
| SCHEMBL11551760 | 0.78 | MAPT (0.38) | NPC1RAB9AHAO1MAPT | |
| SCHEMBL11548494 | 0.78 | PARP10 (0.43) | MMP14EGLN2EGLN1MAPT | |
| SCHEMBL11555622 | 0.77 | ALOX5 (0.46) | ACACBMMP14FFAR1MMP2MMP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4151294-A | Alkynols and process for their preparation | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-04-24 | — | — | US | disclosed |