Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 6/20 | 0.47 |
| ▸ | ACLY | P53396 | 1/20 | 0.46 |
| ▸ | AGTR1 | P30556 | 4/20 | 0.45 |
| ▸ | FABP3 | P05413 | 2/20 | 0.44 |
| ▸ | FABP4 | P15090 | 2/20 | 0.44 |
| ▸ | FABP5 | Q01469 | 2/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | FABP2 | P12104 | 1/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.40 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.40 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.40 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.40 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.40 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5823347 | 0.85 | ACLY (0.62) | HTR6ACLYSRCLMNAPSEN1 | |
| SCHEMBL12392496 | 0.82 | NOD2 (0.48) | HTR6AGTR1LMNAPSEN1PSEN2 | |
| SCHEMBL4119321 | 0.82 | ACLY (0.51) | HTR6ACLYAGTR1FABP3FABP4 | |
| SCHEMBL2732076 | 0.79 | FABP3 (0.50) | HTR6ACLYAGTR1FABP3FABP4 | |
| SCHEMBL6829775 | 0.79 | AKR1C3 (0.48) | HTR6ACLYAGTR1FABP3FABP4 | |
| SCHEMBL28019783 | 0.79 | AGTR1 (0.47) | HTR6ACLYAGTR1FABP3FABP4 | |
| SCHEMBL28184674 | 0.74 | AGTR1 (0.60) | HTR6ACLYAGTR1SMN1; SMN2PSEN1 | |
| SCHEMBL12093313 | 0.74 | HTR6 (0.70) | HTR6FABP3FABP4FABP5SRC | |
| SCHEMBL2929010 | 0.72 | MEN1 (0.45) | HTR6SRCPSEN1PSEN2APH1B | |
| SCHEMBL20505521 | 0.71 | AGTR1 (0.60) | HTR6AGTR1SMN1; SMN2PSEN1PSEN2 |
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-1898927-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | Merck & Co., Inc. (US) | 2008-03-19 | — | — | EP | disclosed |
| WO-2007002481-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | disclosed |