Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | DRD1 | P21728 | 2/20 | 0.38 |
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | DRD5 | P21918 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | DRD3 | P35462 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | APEX1 | P27695 | 2/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14756190 | 0.80 | TAAR1 (0.46) | TAAR1KDM4EADRA2AMAPTDRD2 | |
| SCHEMBL14756308 | 0.80 | NOS1 (0.43) | TAAR1KDM4EADRA2AMAPTDRD2 | |
| SCHEMBL15981481 | 0.76 | TAAR1 (0.39) | TAAR1KDM4EADRA2AMAPTDRD2 | |
| SCHEMBL2597877 | 0.72 | ALDH1A1 (0.59) | KDM4EMAPTALDH1A1TP53HSD17B10 | |
| SCHEMBL14756358 | 0.72 | TAAR1 (0.40) | TAAR1KDM4EADRA2AMAPTDRD2 | |
| Hydrochloric Acid SCHEMBL20562948 | 0.71 | ALDH1A1 (0.58) | KDM4EMAPTALDH1A1TP53HSD17B10 | |
| SCHEMBL3638034 | 0.70 | DHODH (0.49) | TAAR1ALDH1A1CYP1A2 | |
| SCHEMBL24261121 | 0.69 | ALDH1A1 (0.50) | KDM4EALDH1A1TP53HSD17B10CYP1A2 | |
| SCHEMBL7879181 | 0.69 | BACE1 (0.46) | KDM4EMAPTMAPK1TDP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3640635 | 0.69 | DHODH (0.48) | TAAR1ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013033268-A2 | BIVALENT BROMODOMAIN LIGANDS, AND METHODS OF USING SAME | COFERON, INC. (US) | 2013-03-07 | — | — | WO | disclosed |