Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2107219 | 0.88 | NPSR1 (0.45) | NPSR1TSHRRXFP1HDAC3HDAC4 | |
| SCHEMBL1674865 | 0.86 | NPSR1 (0.41) | NPSR1TSHRRXFP1HDAC3HDAC4 | |
| SCHEMBL5660050 | 0.78 | SLC9A1 (0.38) | NPSR1SLC9A1POLBMAPK1ATM | |
| SCHEMBL5835372 | 0.72 | TSHR (0.49) | NPSR1TSHRRXFP1HDAC3HDAC4 | |
| SCHEMBL4958142 | 0.71 | NPSR1 (0.42) | NPSR1TSHRRXFP1HDAC3HDAC4 | |
| SCHEMBL3580017 | 0.70 | NPSR1 (0.39) | NPSR1TSHRRXFP1HDAC3HDAC4 | |
| SCHEMBL28621513 | 0.69 | HDAC3 (0.52) | NPSR1TSHRRXFP1HDAC3HDAC4 | |
| SCHEMBL18669650 | 0.69 | HDAC3 (0.44) | NPSR1TSHRRXFP1HDAC3HDAC4 | |
| Hydrochloric Acid SCHEMBL8100111 | 0.69 | ALDH1A1 (0.43) | NPSR1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL15888121 | 0.67 | HDAC3 (0.50) | NPSR1TSHRRXFP1HDAC3HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1137647-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-10-04 | — | — | EP | disclosed |
| WO-2000034268-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |