Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TK1 | P04183 | 2/20 | 0.51 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.48 |
| ▸ | CTSL | P07711 | 4/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11961126 | 0.88 | P2RX7 (0.52) | TK1P2RX7CTSLADORA2AHDAC1 | |
| SCHEMBL5161068 | 0.85 | HDAC1 (0.51) | P2RX7CTSLADORA2AHDAC1HDAC2 | |
| SCHEMBL24941702 | 0.84 | TK1 (0.60) | TK1ADORA2AHDAC1HDAC2HDAC4 | |
| SCHEMBL30661711 | 0.84 | ADORA2A (0.57) | TK1CTSLADORA2ALMNATP53 | |
| SCHEMBL19553494 | 0.84 | ADORA2A (0.57) | TK1CTSLADORA2ALMNATP53 | |
| SCHEMBL5161283 | 0.84 | HDAC1 (0.49) | P2RX7CTSLADORA2AHDAC1HDAC2 | |
| SCHEMBL8464071 | 0.81 | ADORA2A (0.60) | TK1P2RX7ADORA2AHDAC6ADCY1 | |
| SCHEMBL8467138 | 0.81 | ADORA2A (0.60) | TK1P2RX7ADORA2AHDAC6ADCY1 | |
| SCHEMBL29782726 | 0.79 | ADORA2A (0.48) | TK1CTSLADORA2ACTSBCSNK2A2 | |
| SCHEMBL28654978 | 0.79 | HDAC1 (0.53) | P2RX7HDAC1HDAC2HDAC3HDAC4 |
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-5994361-A | ANTITUMOR, ANTICANCER AGENT | BIOCHEM PHARMA (CA) | 1999-11-30 | — | — | US | claimed |