Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.31 |
| ▸ | ANPEP | P15144 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MC4R | P32245 | 1/20 | 0.30 |
| ▸ | MC3R | P41968 | 1/20 | 0.30 |
| ▸ | MC1R | Q01726 | 1/20 | 0.30 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.30 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2427392 | 0.94 | F2 (0.35) | F2CYP3A4THRBHSD17B10MMP2 | |
| SCHEMBL4303372 | 0.87 | AGTR2 (0.36) | F2CYP3A4THRBHSD17B10MC4R | |
| SCHEMBL2429307 | 0.81 | ABCB1 (0.34) | MMP2ANPEPMC4RMC3RMC1R | |
| SCHEMBL2426240 | 0.79 | KLK5 (0.40) | F2CYP3A4THRBHSD17B10 | |
| SCHEMBL8228152 | 0.79 | CYP3A4 (0.38) | CYP3A4THRBHSD17B10MMP2MC4R | |
| Hydrochloric Acid SCHEMBL2429662 | 0.78 | CYP3A4 (0.38) | F2CYP3A4THRBHSD17B10MMP2 | |
| SCHEMBL2431251 | 0.77 | ABCB1 (0.34) | MC4RMC3RMC1RAGTR2 | |
| SCHEMBL2427394 | 0.76 | CYP3A4 (0.34) | F2CYP3A4THRBHSD17B10 | |
| SCHEMBL4294862 | 0.73 | ACE (0.40) | F2CYP3A4THRBHSD17B10AGTR2 | |
| SCHEMBL2430508 | 0.72 | CACNA1B (0.41) | CYP3A4THRBHSD17B10 |
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-2007148135-A1 | MACROCYCLIC COMPOUNDS AS ANTIVIRAL AGENTS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-12-27 | — | — | WO | disclosed |