Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 4/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 3/20 | 0.37 |
| ▸ | BLM | P54132 | 3/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7150216 | 0.81 | ADRA2A (0.41) | ADRA2AADRA1AADRA2BADRA2CADRB2 | |
| SCHEMBL2250 | 0.73 | ADRA2A (0.61) | ADRA2AADRA1AADRA2BADRA2CADRB2 | |
| SCHEMBL21852127 | 0.71 | ALDH1A1 (0.35) | ADRA1ACYP3A4TSHRHIF1ANFKB1 | |
| SCHEMBL7147316 | 0.71 | KCNH2 (0.54) | ADRB2CYP3A4TAAR1TSHRHIF1A | |
| SCHEMBL166818 | 0.71 | KCNH2 (0.54) | ADRB2CYP3A4TAAR1TSHRHIF1A | |
| SCHEMBL526351 | 0.71 | ALDH1A1 (0.50) | CYP3A4HSD17B10TSHRAPEX1TDP1 | |
| SCHEMBL7149381 | 0.69 | KIF11 (0.46) | ADRA2AADRA1AADRA2BADRA2CADRB2 | |
| SCHEMBL1520565 | 0.68 | ADRA1A (0.54) | ADRA2AADRA1ATSHRNFKB1MAPT | |
| SCHEMBL7148243 | 0.68 | CYP3A4 (0.48) | ADRA2AADRA1AADRA2BADRA2CADRB2 | |
| SCHEMBL38652517 | 0.67 | IDO1 (0.43) | ADRA2AADRA1AADRA2BADRA2CADRB2 |
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-4906781-A | Method for the preparation of 4'-(substituted)-amino-2-(substituted) amino-3',5'-dichloroacetophenone and salts thereof | AMERICAN CYANAMID COMPANY (US) | 1990-03-06 | — | — | US | disclosed |