Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 3/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.43 |
| ▸ | NCOR2 | Q9Y618 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL26847489 | 0.81 | HDAC3 (0.39) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL26847516 | 0.76 | HPGDS (0.39) | KDM4ESMN1; SMN2NPC1LMNARAB9A | |
| SCHEMBL27710726 | 0.71 | KDM4E (0.45) | HDAC1KDM4EPOLBLMNAALDH1A1 | |
| SCHEMBL27731202 | 0.69 | DYRK1A (0.44) | HDAC1 | |
| SCHEMBL25406780 | 0.68 | NPC1 (0.42) | KDM4ESMN1; SMN2POLBTSHRNPC1 | |
| SCHEMBL30567671 | 0.68 | NPC1 (0.42) | KDM4ESMN1; SMN2POLBTSHRNPC1 | |
| SCHEMBL4054124 | 0.68 | KDM4E (0.47) | KDM4ESMN1; SMN2POLBTSHRMEN1 | |
| SCHEMBL4062839 | 0.67 | PRMT5 (0.36) | SMN1; SMN2POLBTSHRNPC1LMNA | |
| SCHEMBL2629295 | 0.65 | KEAP1 (0.53) | KMT2APIK3CA | |
| SCHEMBL4898612 | 0.65 | NPC1 (0.47) | HDAC3HDAC4HDAC1HDAC7HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101232873-A | Pharmaceutical composition comprising a dpp-iv inhibitor | HOFFMANN LA ROCHE (CH) | 2008-07-30 | — | — | CN | disclosed |