Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | CDK4 | P11802 | 1/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.44 |
| ▸ | CCND1 | P24385 | 1/20 | 0.44 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.44 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.44 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 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 | |
|---|---|---|---|---|
| SCHEMBL1564257 | 1.00 | NR4A2 (0.48) | NR4A2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL13754874 | 0.85 | NR1H4 (0.55) | NR4A2MEN1KMT2AALDH1A1MAOB | |
| SCHEMBL1564241 | 0.85 | NR1H4 (0.55) | NR4A2MEN1KMT2AALDH1A1MAOB | |
| SCHEMBL29992466 | 0.84 | MAOB (0.58) | NR4A2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL19859637 | 0.84 | MAOB (0.58) | NR4A2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL9756901 | 0.81 | ALDH1A1 (0.63) | NR4A2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL9756904 | 0.81 | ALDH1A1 (0.63) | NR4A2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL1562635 | 0.79 | P4HTM (0.58) | NR4A2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL13427738 | 0.79 | P4HTM (0.58) | NR4A2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL13754943 | 0.78 | NR3C2 (0.50) | KDM4EALOX5CYP3A4 |
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-7576198-B1 | Integrase inhibitors containing aromatic heterocycle derivatives | SHIONOGI & CO., LTD. (JP) | 2009-08-18 | — | — | US | disclosed |
| US-7576198-B1 | Integrase inhibitors containing aromatic heterocycle derivatives | SHIONOGI & CO., LTD. (JP) | 2009-08-18 | — | — | US | disclosed |