Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 2/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.44 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.43 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TRHDE | Q9UKU6 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5145729 | 0.85 | BACE1 (0.54) | MAPTROCK2BACE1HDAC8KDM4E | |
| SCHEMBL1614525 | 0.85 | BACE1 (0.54) | MAPTROCK2BACE1HDAC8KDM4E | |
| SCHEMBL28556648 | 0.82 | MAPT (0.65) | MAPTTP53BACE1HDAC8KDM4E | |
| SCHEMBL28556649 | 0.82 | MAPT (0.65) | MAPTTP53BACE1HDAC8KDM4E | |
| Aminobenzoic Acid SCHEMBL5668488 | 0.78 | LNPEP (0.51) | ROCK2BACE1HDAC8KDM4EMEN1 | |
| SCHEMBL4610411 | 0.77 | BACE1 (0.57) | MAPTBACE1HDAC8KDM4EPOLB | |
| SCHEMBL21880195 | 0.75 | ROCK2 (0.60) | ROCK2BACE1HDAC8MEN1NPC1 | |
| SCHEMBL10176502 | 0.75 | ROCK2 (0.60) | ROCK2BACE1HDAC8MEN1NPC1 | |
| SCHEMBL6663334 | 0.75 | ROCK2 (0.60) | ROCK2BACE1HDAC8MEN1NPC1 | |
| SCHEMBL20353450 | 0.73 | ROCK2 (0.69) | ROCK2ROCK1AKT1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0973936-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 2000-01-26 | — | — | EP | disclosed |
| EP-0946549-A1 | COMBINATORIAL PROCESS FOR PREPARING FUSED PYRIMIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1999-10-06 | — | — | EP | disclosed |
| EP-0938676-A1 | COMBINATORIAL PROCESS FOR PREPARING THIAZOLIDINONE LIBRARIES | ELI LILLY AND COMPANY (US) | 1999-09-01 | — | — | EP | disclosed |
| WO-1998046786-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |
| WO-1998027087-A1 | COMBINATORIAL PROCESS FOR PREPARING FUSED PYRIMIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-06-25 | — | — | WO | disclosed |
| WO-1998021584-A1 | COMBINATORIAL PROCESS FOR PREPARING THIAZOLIDINONE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-05-22 | — | — | WO | disclosed |