Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6891746 | 0.82 | RIPK1 (0.50) | RIPK1CYP3A4MAPTKDM4EIDO1 | |
| SCHEMBL14145021 | 0.81 | CYP3A4 (0.50) | RIPK1CYP3A4MAPTKDM4EIDO1 | |
| SCHEMBL11872500 | 0.80 | EPHX2 (0.41) | RIPK1CYP3A4MAPTKDM4EATM | |
| SCHEMBL20163215 | 0.80 | RIPK1 (0.49) | RIPK1CYP3A4MAPTKDM4EIDO1 | |
| SCHEMBL928816 | 0.79 | CYP3A4 (0.48) | RIPK1CYP3A4MAPTKDM4EIDO1 | |
| SCHEMBL20686991 | 0.78 | RIPK1 (0.50) | RIPK1CYP3A4MAPTKDM4EIDO1 | |
| SCHEMBL6325947 | 0.77 | RIPK1 (0.50) | RIPK1CYP3A4MAPTIDO1THRB | |
| SCHEMBL11751773 | 0.75 | CYP2D6 (0.48) | RIPK1CYP3A4MAPTKDM4EIDO1 | |
| SCHEMBL19963515 | 0.75 | CYP2D6 (0.48) | RIPK1CYP3A4MAPTKDM4EIDO1 | |
| SCHEMBL28672017 | 0.75 | HTT (0.48) | RIPK1CYP3A4MAPTKDM4EIDO1 |
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-4136116-A | ANTIDEPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1979-01-23 | — | — | US | disclosed |
| US-3952017-A | 5-HYDROXY-5-(METHYL OR ALKYLMETHYL-AMINOPROPYL)- 5H-DIBENZO(A,D)CYCLOHEPTENES, ANTIDEPRESSANT | HOFFMANN-LA ROCHE INC. (US) | 1976-04-20 | — | — | US | disclosed |