Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 3/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.34 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11240562 | 0.77 | ACHE (0.49) | ACHEKDM4EPOLBADRB1ADRB3 | |
| SCHEMBL11142307 | 0.75 | ADRB2 (0.51) | ADRB1ADRB3CYP2D6ADRB2 | |
| SCHEMBL6491444 | 0.74 | HTR1A (0.42) | KDM4ESMN1; SMN2HTR1AHTR7ALDH1A1 | |
| SCHEMBL6508045 | 0.74 | HTR1A (0.42) | KDM4ESMN1; SMN2HTR1AHTR7ALDH1A1 | |
| SCHEMBL11665347 | 0.72 | HTR1A (0.41) | KDM4ESMN1; SMN2HTR1AHTR7ALDH1A1 | |
| SCHEMBL11821380 | 0.72 | ACHE (0.45) | ACHEKDM4EPOLBADRB1ADRB3 | |
| SCHEMBL11431426 | 0.71 | MEN1 (0.58) | ACHEADRB1ADRB3CYP2D6SMN1; SMN2 | |
| SCHEMBL8668148 | 0.71 | MEN1 (0.58) | ACHEADRB1ADRB3CYP2D6SMN1; SMN2 | |
| SCHEMBL11246135 | 0.69 | SMN1; SMN2 (0.36) | KDM4ESMN1; SMN2ALDH1A1 | |
| SCHEMBL11548581 | 0.68 | ADRB1 (0.49) | KDM4EADRB1ADRB3CYP2D6ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4391980-A | FOR INVERSION OF CONFIGURATION OF OPTICALLY ACTIVE COMPOUNDS | CIBA-GEIGY CORPORATION (US) | 1983-07-05 | — | — | US | disclosed |
| US-4294966-A | SALT FORMATION | CIBA-GEIGY CORPORATION (US) | 1981-10-13 | — | — | US | disclosed |