Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.64 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.64 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 5/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | CTSB | P07858 | 1/20 | 0.48 |
| ▸ | CTSS | P25774 | 1/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3078403 | 0.88 | TAS1R3 (0.78) | TAS1R3TAS1R1PIN1HDAC3HDAC4 | |
| SCHEMBL704949 | 0.88 | TAS1R3 (0.78) | TAS1R3TAS1R1PIN1HDAC3HDAC4 | |
| SCHEMBL14362858 | 0.80 | TAS1R3 (0.78) | TAS1R3TAS1R1PIN1HDAC3HDAC4 | |
| SCHEMBL14360883 | 0.78 | HDAC3 (0.59) | TAS1R3TAS1R1HDAC3HDAC4HDAC1 | |
| SCHEMBL7241995 | 0.78 | TAS1R3 (1.00) | TAS1R3TAS1R1PIN1HDAC3HDAC4 | |
| SCHEMBL4192862 | 0.78 | TAS1R3 (1.00) | TAS1R3TAS1R1PIN1HDAC3HDAC4 | |
| SCHEMBL10226447 | 0.78 | TAS1R3 (1.00) | TAS1R3TAS1R1PIN1HDAC3HDAC4 | |
| SCHEMBL14605678 | 0.78 | TAS1R3 (0.70) | TAS1R3TAS1R1PIN1HDAC3HDAC4 | |
| SCHEMBL8237060 | 0.75 | HDAC3 (0.55) | TAS1R3TAS1R1HDAC3HDAC4HDAC1 | |
| SCHEMBL3913711 | 0.75 | PIN1 (0.64) | TAS1R3TAS1R1PIN1HDAC3HDAC4 |
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-1200457-B1 | CYSTEINE PROTEASE INHIBITORS | NAEJA PHARMACEUTICAL INC (CA) | 2004-08-25 | — | — | EP | disclosed |
| US-6635621-B1 | Alpha amino acid amide derivatives; reducing cathepsins B, L, S and/or K activity | NAEJA PHARMACEUTICAL INC. (CA) | 2003-10-21 | — | — | US | disclosed |