Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLN | Q9BYT8 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.43 |
| ▸ | PYGL | P06737 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12107481 | 0.90 | NLN (0.48) | NLNHDAC1 | |
| SCHEMBL15443594 | 0.81 | NLN (0.48) | NLNHDAC1CYP11B1CYP11B2HDAC3 | |
| SCHEMBL18480825 | 0.81 | MASP2 (0.55) | — | |
| SCHEMBL20900140 | 0.81 | MASP2 (0.55) | — | |
| SCHEMBL15116822 | 0.81 | NLN (0.48) | NLNHDAC1HDAC3PTGER3 | |
| SCHEMBL20054551 | 0.81 | NLN (0.48) | NLNHDAC1HDAC3PTGER3 | |
| SCHEMBL19388724 | 0.81 | NLN (0.48) | NLNHDAC1HDAC3PTGER3 | |
| SCHEMBL15443396 | 0.80 | NLN (0.47) | NLNHDAC1CYP11B1CYP11B2HDAC3 | |
| Hydrochloric Acid SCHEMBL18438992 | 0.80 | MASP2 (0.53) | — | |
| SCHEMBL17212586 | 0.78 | NLN (0.45) | NLNHDAC1CYP11B1CYP11B2HDAC3 |
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-2012074437-A2 | SUBSTITUTED AZOLES, ANTI-VIRAL ACTIVE INGREDIENT, PHARMACEUTICAL COMPOSITION, METHOD FOR THE PRODUCTION AND USE THEREOF | АЛЛА ХЕМ, ЛЛС (US) | 2012-06-07 | — | — | WO | disclosed |