Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8457131 | 0.88 | TSHR (0.49) | SMN1; SMN2LTA4HCETPLMNATSHR | |
| SCHEMBL8736686 | 0.87 | ALDH1A1 (0.43) | SMN1; SMN2TSHRHTTCYP2C19FFAR1 | |
| SCHEMBL8154438 | 0.85 | TSHR (0.49) | SMN1; SMN2LTA4HCETPLMNATSHR | |
| SCHEMBL8736669 | 0.85 | HDAC3 (0.57) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL8159050 | 0.84 | TSHR (0.48) | SMN1; SMN2LTA4HCETPLMNATSHR | |
| SCHEMBL8735897 | 0.80 | SMN1; SMN2 (0.51) | MAPK1SMN1; SMN2LMNACYP2C19 | |
| SCHEMBL7628886 | 0.79 | HDAC3 (0.49) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL8732951 | 0.78 | NPSR1 (0.50) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL7608422 | 0.77 | ACP3 (0.40) | SMN1; SMN2FOLH1 | |
| SCHEMBL7606733 | 0.76 | ANPEP (0.40) | FOLH1 |
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-5795877-A | Inhibitors of NAALADase enzyme activity | GUILFORD PHARMACEUTICALS INC. (US) | 1998-08-18 | — | — | US | claimed |
| US-5795877-A | Inhibitors of NAALADase enzyme activity | GUILFORD PHARMACEUTICALS INC. (US) | 1998-08-18 | — | — | US | disclosed |