Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3305686 | 0.74 | CYP3A4 (0.38) | CYP2C19TDP1MEN1KMT2ANPSR1 | |
| SCHEMBL17660041 | 0.74 | DHFR (0.46) | CYP2C19TDP1MEN1KMT2ANPSR1 | |
| SCHEMBL10473072 | 0.74 | DHFR (0.46) | CYP2C19TDP1MEN1KMT2ANPSR1 | |
| SCHEMBL17598759 | 0.73 | TDP1 (0.43) | TDP1MEN1KMT2ANPSR1KCNH2 | |
| SCHEMBL5513765 | 0.73 | TDP1 (0.43) | TDP1MEN1KMT2ANPSR1KCNH2 | |
| SCHEMBL17584973 | 0.72 | TDP1 (0.42) | TDP1MEN1KMT2ANPSR1KCNH2 | |
| SCHEMBL17431097 | 0.71 | CYP2C19 (0.50) | CYP2C19TDP1MEN1KMT2ANPSR1 | |
| SCHEMBL20025824 | 0.71 | CYP2C19 (0.44) | CYP2C19TDP1CNR2ATMALDH1A1 | |
| SCHEMBL20021864 | 0.71 | TSHR (0.46) | CYP2C19TDP1NPSR1CNR2ATM | |
| SCHEMBL11729095 | 0.71 | TSHR (0.41) | CYP2C19TDP1MEN1KMT2ANPSR1 |
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-4028429-A | ORGANONICKEL-ALUMINUM-AMINEPHOSPHINE COMPLEX | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-06-07 | — | — | US | disclosed |