Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 9/20 | 0.54 |
| ▸ | CES1 | P23141 | 8/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | MTOR | P42345 | 3/20 | 0.44 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.44 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL15209694 | 0.93 | CES2 (0.61) | CES2CES1HDAC1HDAC2GRM5 | |
| SCHEMBL29875488 | 0.89 | MTOR (0.44) | CES2CES1HDAC1HDAC2GRM5 | |
| SCHEMBL30967896 | 0.87 | MGLL (0.42) | CES2CES1HDAC1HDAC2GRM5 | |
| SCHEMBL2655720 | 0.86 | MTOR (0.56) | CES2CES1HDAC1HDAC2GRM5 | |
| SCHEMBL3673834 | 0.85 | ATM (0.58) | HDAC1HDAC2GRM5F2MTOR | |
| SCHEMBL2163420 | 0.83 | HDAC1 (0.45) | HDAC1HDAC2GRM5F2MTOR | |
| SCHEMBL40282 | 0.83 | CA12 (0.58) | MTOR | |
| SCHEMBL29532021 | 0.83 | CA12 (0.58) | MTOR | |
| SCHEMBL28278184 | 0.82 | MTOR (0.40) | CES2CES1HDAC1HDAC2GRM5 | |
| SCHEMBL29237489 | 0.82 | HDAC1 (0.42) | CES2CES1HDAC1HDAC2GRM5 |
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 |
|---|---|---|---|---|---|---|---|
| US-9441163-B2 | Photoalignment of materials including liquid crystals | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2016-09-13 | — | — | US | disclosed |
| US-9441163-B2 | Photoalignment of materials including liquid crystals | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2016-09-13 | — | — | US | disclosed |