Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | LITAF | Q99732 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | MPL | P40238 | 1/20 | 0.35 |
| ▸ | CTSC | P53634 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL437620 | 0.82 | ALOX5AP (0.38) | HAVCR2TNFLITAFADORA2AADORA1 | |
| SCHEMBL436008 | 0.80 | HTR1A (0.44) | HAVCR2CYP3A4KDM4E | |
| SCHEMBL437574 | 0.77 | PARP1 (0.45) | HAVCR2NR4A2 | |
| SCHEMBL441707 | 0.76 | HAVCR2 (0.63) | HAVCR2CYP1A2NR4A2KDM4EACHE | |
| SCHEMBL23497102 | 0.75 | PDE4A (0.42) | TNFLITAFP2RX7ADORA2AADORA1 | |
| SCHEMBL29828879 | 0.75 | PI4KA (0.42) | TNFLITAFADORA2AADORA1ALOX5AP | |
| SCHEMBL29829215 | 0.75 | PDE4A (0.42) | TNFLITAFP2RX7ADORA2AADORA1 | |
| SCHEMBL441422 | 0.74 | HAVCR2 (0.46) | HAVCR2NR4A2ACHE | |
| SCHEMBL29233308 | 0.73 | TNF (0.39) | TNFLITAFADORA2AADORA1ALOX5AP | |
| SCHEMBL29989486 | 0.72 | PIN1 (0.45) | TNFLITAFHPGDKDM4EKMT2A |
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-20120065166-A1 | Bone Modulators And Methods Therewith | ESPINA VIRGINIA (US) | 2012-03-15 | — | — | US | disclosed |