Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9134820 | 0.87 | KDM4E (0.45) | KDM4EALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9131446 | 0.84 | KDM4E (0.48) | KDM4EALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9130259 | 0.83 | SIGMAR1 (0.44) | KDM4EDRD2HTR1AHTR2ADRD4 | |
| SCHEMBL11567437 | 0.82 | DRD2 (0.49) | CYP1A2CYP2C19DRD2HTR7HTR1A | |
| SCHEMBL10752570 | 0.80 | HTR1A (0.54) | MAOBDRD2HTR7HTR1AHTR2A | |
| SCHEMBL11668436 | 0.77 | KMT2A (0.39) | ALDH1A1CYP1A2CYP2D6ABCB1 | |
| SCHEMBL11567096 | 0.76 | ADORA2A (0.36) | DRD2DRD4DRD3 | |
| SCHEMBL9130488 | 0.76 | DRD2 (0.46) | KDM4EMAPTDRD2MAPK1HTR7 | |
| SCHEMBL9131769 | 0.75 | DRD2 (0.44) | ALDH1A1MAPTDRD2HTR7LMNA | |
| SCHEMBL10744900 | 0.74 | HTR7 (0.44) | KDM4EMAPTHTR7HTR1ADRD3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4711960-A | HYPOTENSIVE, ANTIPSYCHOTIC AGENTS | THE UPJOHN COMPANY (US) | 1987-12-08 | — | — | US | disclosed |
| US-4577021-A | PSYCHOLOGICAL DISORDERS, HYPOTENSIVE | THE UPJOHN COMPANY (US) | 1986-03-18 | — | — | US | disclosed |
| US-4487774-A | Isochromans | THE UPJOHN COMPANY (US) | 1984-12-11 | — | — | US | disclosed |