Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 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 | |
|---|---|---|---|---|
| SCHEMBL14996178 | 0.85 | ESR1 (0.51) | HDAC8HDAC6AKR1C3AKR1C2TDP1 | |
| SCHEMBL12191565 | 0.84 | APAF1 (0.50) | POLBAPAF1ALDH1A1LMNA | |
| SCHEMBL22267938 | 0.83 | HDAC8 (0.41) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL19257724 | 0.81 | GRIA4 (0.41) | HDAC8HDAC6ENPEPAKR1C3AKR1C2 | |
| SCHEMBL13418590 | 0.80 | NR1I2 (0.38) | HDAC8HDAC6AKR1C3AKR1C2SMN1; SMN2 | |
| SCHEMBL19199258 | 0.78 | ADRA2A (0.40) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL10429251 | 0.77 | LMNA (0.50) | POLBSMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL12384004 | 0.77 | GRIA4 (0.39) | HDAC8HDAC6ADRA2AADRA2BADRA2C | |
| SCHEMBL13418600 | 0.75 | APAF1 (0.45) | APAF1LMNACYP1A2 | |
| SCHEMBL22267939 | 0.75 | ALDH1A1 (0.38) | HDAC8HDAC6ENPEPAKR1C3POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017134547-A1 | TUBULYSIN ANALOGS AND METHODS FOR THEIR PREPARATION | PFIZER INC. (US) | 2017-08-10 | — | — | WO | disclosed |