Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.74 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.61 |
| ▸ | LOXL2 | Q9Y4K0 | 4/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ABAT | P80404 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL240341 | 0.92 | TAAR1 (0.62) | HRH3TAAR1LOXL2CYP2A6PSIP1 | |
| SCHEMBL1702558 | 0.86 | TP53 (0.56) | HRH3TAAR1CYP2A6TP53EGFR | |
| SCHEMBL2776957 | 0.86 | TP53 (0.56) | HRH3TAAR1CYP2A6TP53EGFR | |
| SCHEMBL2274647 | 0.86 | HRH3 (1.00) | HRH3TAAR1LOXL2CYP2A6ADRB2 | |
| SCHEMBL22536884 | 0.84 | TAAR1 (0.68) | HRH3TAAR1LOXL2CYP2A6PSIP1 | |
| SCHEMBL26030924 | 0.84 | TAAR1 (0.54) | HRH3TAAR1LOXL2CYP2A6PSIP1 | |
| SCHEMBL14305563 | 0.83 | TAAR1 (0.59) | HRH3TAAR1LOXL2CYP2A6 | |
| SCHEMBL9467191 | 0.80 | TAAR1 (0.86) | TAAR1CYP2A6 | |
| Ethylbenzene SCHEMBL27229 | 0.79 | LOXL2 (0.74) | HRH3TAAR1LOXL2CYP2A6TP53 | |
| SCHEMBL19139628 | 0.79 | CYP3A4 (0.58) | HRH3TAAR1LOXL2TP53EGFR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021119249-A1 | CYCLOPHILIN D INHIBITORS AND USES THEREOF | THE BROAD INSTITUTE, INC. (US) | 2021-06-17 | — | — | WO | disclosed |
| WO-2009077186-A1 | NONSTEROIDAL PROGESTERONE RECEPTOR MODULATORS | BAYER SCHERING PHARMA AKTIENGESLLSCHAFT (DE) | 2009-06-25 | — | — | WO | disclosed |