Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.52 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.52 |
| ▸ | MTOR | P42345 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL24630978 | 1.00 | ADRB2 (0.52) | ADRB2TSHRADRB1MAPTHIF1A | |
| SCHEMBL11476231 | 0.89 | ADRB2 (0.52) | ADRB2TSHRADRB1MAPTHIF1A | |
| SCHEMBL11474610 | 0.89 | ADRB2 (0.52) | ADRB2TSHRADRB1MAPTHIF1A | |
| SCHEMBL11603315 | 0.89 | ADRB2 (0.52) | ADRB2TSHRADRB1MAPTHIF1A | |
| Hydrochloric Acid SCHEMBL11487096 | 0.88 | ADRB2 (0.54) | ADRB2TSHRADRB1MAPTHIF1A | |
| Hydrochloric Acid SCHEMBL11487093 | 0.88 | ADRB2 (0.54) | ADRB2TSHRADRB1MAPTHIF1A | |
| SCHEMBL22864145 | 0.85 | HTT (0.46) | MAPTKDM4EMAPK1KMT2APOLB | |
| SCHEMBL24631003 | 0.80 | EPHX1 (0.49) | ADRB2KDM4EMAPK1LMNAPOLB | |
| SCHEMBL10467019 | 0.79 | PRKCI (0.51) | ADRB2TSHRADRB1MAPTHIF1A | |
| SCHEMBL24631002 | 0.79 | HTT (0.41) | ADRB2TSHRADRB1MAPTHIF1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4204069-A | 1-(5-BENZIMIDAZOYL)-2-ISOPROPYLAMINOETHANOL FROM ACETONE AND 1-(5-BENZIMIDAZOYL)-2-AMINOETHANOL | MERCK & CO., INC. (US) | 1980-05-20 | — | — | US | disclosed |
| US-4204069-A | 1-(5-BENZIMIDAZOYL)-2-ISOPROPYLAMINOETHANOL FROM ACETONE AND 1-(5-BENZIMIDAZOYL)-2-AMINOETHANOL | MERCK & CO., INC. (US) | 1980-05-20 | — | — | US | disclosed |
| US-4082847-A | 1-(5-BENZIMIDAZOLYL)-2-ISOPROPYLAMINOETHANOL, BRONCHODILATION, REDUCING INTRAOCULAR PRESSURE | MERCK & CO., INC. (US) | 1978-04-04 | — | — | US | disclosed |
| US-4082847-A | 1-(5-BENZIMIDAZOLYL)-2-ISOPROPYLAMINOETHANOL, BRONCHODILATION, REDUCING INTRAOCULAR PRESSURE | MERCK & CO., INC. (US) | 1978-04-04 | — | — | US | disclosed |