Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD2 | Q9NRG4 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 4/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FGB | P02675 | 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 | |
|---|---|---|---|---|
| SCHEMBL31276323 | 0.91 | SMYD2 (0.40) | SMYD2HTTSMN1; SMN2CYP3A4MAOA | |
| SCHEMBL31139029 | 0.91 | SMYD2 (0.40) | SMYD2HTTSMN1; SMN2CYP3A4MAOA | |
| SCHEMBL31139004 | 0.91 | SMYD2 (0.40) | SMYD2HTTSMN1; SMN2CYP3A4MAOA | |
| SCHEMBL4945388 | 0.88 | SMYD2 (0.38) | SMYD2HTTSMN1; SMN2CYP3A4 | |
| SCHEMBL3856852 | 0.85 | CYP3A4 (0.36) | SMYD2HTTSMN1; SMN2CYP3A4SIGMAR1 | |
| SCHEMBL28946558 | 0.85 | SMYD2 (0.41) | SMYD2HTTSMN1; SMN2CYP3A4SLC6A2 | |
| SCHEMBL28946557 | 0.85 | SMYD2 (0.41) | SMYD2HTTSMN1; SMN2CYP3A4SLC6A2 | |
| SCHEMBL4815429 | 0.85 | SMYD2 (0.41) | SMYD2HTTSMN1; SMN2CYP3A4SLC6A2 | |
| SCHEMBL8215769 | 0.85 | SMYD2 (0.39) | SMYD2HTTSMN1; SMN2CYP3A4 | |
| SCHEMBL14508005 | 0.84 | CYP3A4 (0.36) | SMYD2HTTSMN1; SMN2CYP3A4SIGMAR1 |
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-2023215989-A1 | SULFUR-CONTAINING LIPIDS | NANOVATION THERAPEUTICS INC. (CA) | 2023-11-16 | — | — | WO | disclosed |
| CN-115340537-A | Quinazoline compound, preparation method and application thereof | 上海医药集团股份有限公司 | 2022-11-15 | — | — | CN | disclosed |