Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I3 | Q14994 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | TERT | O14746 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3504318 | 0.81 | ACHE (0.41) | HSP90AA1HSP90AB1GAACSNK2A1KDM4E | |
| SCHEMBL6959886 | 0.81 | ALDH1A1 (0.53) | TSHRKDM4EHSD17B10CYP3A4USP2 | |
| SCHEMBL3505581 | 0.80 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1POLBCSNK2A1KDM4E | |
| SCHEMBL3504561 | 0.78 | ALDH1A1 (0.46) | HSP90AA1HSP90AB1GAACSNK2A1KDM4E | |
| SCHEMBL8184622 | 0.78 | CYP3A4 (0.45) | HSP90AA1HSP90AB1TSHRKDM4EACHE | |
| SCHEMBL3505061 | 0.77 | KDM4E (0.53) | HSP90AA1HSP90AB1POLBTSHRKDM4E | |
| SCHEMBL3505069 | 0.76 | GAA (0.45) | GAAKDM4EACHEHSD17B10ALDH1A1 | |
| SCHEMBL3503323 | 0.75 | HSP90AA1 (0.45) | HSP90AA1HSP90AB1GAAKDM4EACHE | |
| SCHEMBL3504880 | 0.75 | ALDH1A1 (0.56) | HSP90AA1HSP90AB1POLBTSHRKDM4E | |
| SCHEMBL3506032 | 0.75 | CYP1A2 (0.50) | HSP90AA1HSP90AB1GAAPOLBKDM4E |
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-5494908-A | ANTIDEPRESSANT | HOECHST-ROUSSEL PHARMACEUTICAL INCORPORATED (US) | 1996-02-27 | — | — | US | claimed |