Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.78 |
| ▸ | RAB9A | P51151 | 3/20 | 0.78 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.72 |
| ▸ | MEN1 | O00255 | 3/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.59 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.59 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.58 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.58 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL25605335 | 1.00 | NPC1 (0.78) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL25730123 | 0.84 | KMT2A (0.64) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL22784252 | 0.81 | NOTUM (0.64) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL1264115 | 0.81 | HDAC6 (0.60) | NPC1RAB9AKMT2AMEN1HDAC3 | |
| SCHEMBL25589679 | 0.81 | KMT2A (0.63) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL5458095 | 0.81 | KDM4E (0.65) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL3244156 | 0.81 | HPGD (0.68) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL20752768 | 0.81 | NOTUM (0.67) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL17482292 | 0.80 | KMT2A (0.62) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL13487186 | 0.80 | NOTUM (0.67) | NPC1RAB9AKMT2AMEN1ALDH1A1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4200280-B1 | PHENYL-3,4-DIHYDROISOQUINOLIN-2(1H)-YL-ETHAN-1-ONE DERIVATIVES AS DOPAMINE D1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | LILLY CO ELI (US) | 2024-02-21 | — | — | EP | disclosed |
| CN-116601146-A | Phenyl-3, 4-dihydroisoquinolin-2 (1H) -yl-ethan-1-one derivatives as positive allosteric modulators of dopamine D1 receptor | 伊莱利利公司 | 2023-08-15 | — | — | CN | disclosed |
| CN-116601146-A | Phenyl-3, 4-dihydroisoquinolin-2 (1H) -yl-ethan-1-one derivatives as positive allosteric modulators of dopamine D1 receptor | 伊莱利利公司 | 2023-08-15 | — | — | CN | disclosed |
| EP-4200280-A1 | PHENYL-3,4-DIHYDROISOQUINOLIN-2(1H)-YL-ETHAN-1-ONE DERIVATIVES AS DOPAMINE D1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | ELI LILLY AND COMPANY (US) | 2023-06-28 | — | — | EP | disclosed |
| EP-4200280-A1 | PHENYL-3,4-DIHYDROISOQUINOLIN-2(1H)-YL-ETHAN-1-ONE DERIVATIVES AS DOPAMINE D1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | ELI LILLY AND COMPANY (US) | 2023-06-28 | — | — | EP | disclosed |
| WO-2022076418-A1 | PHENYL-3,4-DIHYDROISOQUINOLIN-2(1H)-YL-ETHAN-1-ONE DERIVATIVES AS DOPAMINE D1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | ELI LILLY AND COMPANY (US) | 2022-04-14 | — | — | WO | disclosed |
| WO-2022076418-A1 | PHENYL-3,4-DIHYDROISOQUINOLIN-2(1H)-YL-ETHAN-1-ONE DERIVATIVES AS DOPAMINE D1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | ELI LILLY AND COMPANY (US) | 2022-04-14 | — | — | WO | disclosed |