Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30738237 | 0.83 | TDP1 (0.62) | TSHRTDP1KMT2AALDH1A1LMNA | |
| SCHEMBL8014873 | 0.80 | KDM4E (0.46) | TSHRKMT2AALDH1A1POLBMEN1 | |
| SCHEMBL6757866 | 0.80 | KDM4E (0.46) | TSHRKMT2AALDH1A1POLBMEN1 | |
| SCHEMBL28888192 | 0.75 | CASP6 (0.39) | TSHRTDP1KMT2AALDH1A1POLB | |
| SCHEMBL23909557 | 0.75 | ALDH1A1 (0.54) | TSHRTDP1KMT2AALDH1A1LMNA | |
| SCHEMBL723147 | 0.74 | ALDH1A1 (0.47) | TSHRTDP1KMT2AALDH1A1LMNA | |
| SCHEMBL724233 | 0.73 | ALDH1A1 (0.46) | TSHRTDP1KMT2AALDH1A1LMNA | |
| SCHEMBL23909587 | 0.72 | ALDH1A1 (0.54) | TSHRTDP1KMT2AALDH1A1LMNA | |
| SCHEMBL27578995 | 0.71 | TDP1 (0.45) | TSHRTDP1KMT2AALDH1A1LMNA | |
| Phenylboronic Acid SCHEMBL723146 | 0.71 | ALDH1A1 (0.44) | TSHRTDP1KMT2AALDH1A1LMNA |
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-101208341-B | Hexarylene and pentarylene tetracarboxylic acid diimides | BASF AG | 2014-12-10 | — | — | CN | disclosed |
| CN-101208341-A | Hexarylene and pentarylene tetracarboxylic acid diimides | BASF AG (DE) | 2008-06-25 | — | — | CN | disclosed |