Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.43 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | FABP3 | P05413 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL29960523 | 0.80 | TSHR (0.43) | MAP3K14KDM4EMTNR1AMTNR1B | |
| SCHEMBL10836336 | 0.80 | CYP1A2 (0.45) | CYP1A2CYP2D6CYP2C9CYP2C19HIF1A | |
| SCHEMBL16547283 | 0.75 | MAP3K14 (0.41) | MAP3K14 | |
| Hydrochloric Acid SCHEMBL29960378 | 0.73 | MAP3K14 (0.42) | MAP3K14 | |
| SCHEMBL13035445 | 0.68 | MAP3K14 (0.40) | MAP3K14MTNR1AMTNR1B | |
| SCHEMBL8576142 | 0.67 | FFAR2 (0.45) | — | |
| SCHEMBL8580943 | 0.67 | FFAR2 (0.45) | — | |
| SCHEMBL1519203 | 0.67 | FFAR2 (0.45) | — | |
| SCHEMBL31166527 | 0.66 | SLC9A1 (0.68) | SLC9A1MTNR1B | |
| SCHEMBL15805074 | 0.66 | SLC9A1 (0.68) | SLC9A1MTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022204150-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS | BLUE OAK PHARMACEUTICALS, INC. (US) | 2022-09-29 | — | — | WO | disclosed |