Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | GABRR3 | A8MPY1 | 1/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21019423 | 1.00 | CYP1A2 (0.44) | CYP1A2TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL19733663 | 0.84 | ALDH1A1 (0.50) | KMT2ALMNACHRNB2CHRNB4CHRNA4 | |
| SCHEMBL12126332 | 0.82 | PAOX (0.35) | TSHRLMNACHRNB2CHRNB4CHRNA4 | |
| SCHEMBL9915021 | 0.79 | CA1 (0.37) | TSHRHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL13895336 | 0.79 | CYP1A2 (0.42) | CYP1A2TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL20724958 | 0.78 | SMN1; SMN2 (0.36) | TSHRKMT2ACHRNB2CHRNA4SMN1; SMN2 | |
| SCHEMBL4590240 | 0.78 | SMN1; SMN2 (0.36) | TSHRKMT2ACHRNB2CHRNA4SMN1; SMN2 | |
| SCHEMBL18907009 | 0.76 | ALOX5 (0.31) | CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL23342978 | 0.75 | KMT2A (0.40) | CYP1A2KMT2ACHRNB2CHRNB4CHRNA4 | |
| SCHEMBL24183277 | 0.75 | LMNA (0.45) | CYP1A2TSHRHDAC3HDAC4HDAC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017089894-A1 | CONJUGATES COMPRISING PEPTIDE GROUPS AND METHODS RELATED THERETO | LEGOCHEM BIOSCIENCES, INC. (KR) | 2017-06-01 | — | — | WO | disclosed |
| WO-2017089890-A1 | CONJUGATES COMPRISING SELF-IMMOLATIVE GROUPS AND METHODS RELATED THERETO | LEGOCHEM BIOSCIENCES, INC. (KR) | 2017-06-01 | — | — | WO | disclosed |
| WO-2017089895-A1 | ANTIBODY-DRUG CONJUGATES COMPRISING BRANCHED LINKERS AND METHODS RELATED THERETO | LEGOCHEM BIOSCIENCES, INC. (KR) | 2017-06-01 | — | — | WO | disclosed |