Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | NPY1R | P25929 | 4/20 | 0.35 |
| ▸ | NPY4R | P50391 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.32 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL18261734 | 0.80 | AKT1 (0.38) | NPY1RAKT1 | |
| SCHEMBL31626679 | 0.76 | ALDH1A1 (0.37) | ALDH1A1ITGB3ITGA2BLMNAPKM | |
| Trifluoroacetic Acid SCHEMBL18261651 | 0.75 | PKM (0.38) | ALDH1A1ITGB3ITGB1ITGA2BITGA5 | |
| Trifluoroacetic Acid SCHEMBL16095879 | 0.73 | DRD2 (0.46) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| Trifluoroacetic Acid SCHEMBL18261754 | 0.71 | MGLL (0.47) | NPY1RNPY4RITGB3ITGB1ITGA2B | |
| SCHEMBL22134518 | 0.71 | TSHR (0.40) | ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL4397272 | 0.69 | KDM4E (0.42) | ALDH1A1NPY1RNPY4RHDAC3HDAC4 | |
| SCHEMBL17841877 | 0.68 | TERT (0.40) | AKT1 | |
| SCHEMBL30269173 | 0.68 | TERT (0.40) | AKT1 | |
| SCHEMBL4418973 | 0.68 | GABBR2 (0.35) | ALDH1A1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103826661-A | Novel binding agent-drug conjugates (ADCs) and uses thereof | SEATTLE GENETICS INC | 2014-05-28 | — | — | CN | disclosed |
| CN-103764170-A | Novel binder-drug conjugates (ADCs) and their use | SEATTLE GENETICS INC | 2014-04-30 | — | — | CN | disclosed |