Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27658679 | 0.85 | ALDH1A1 (0.46) | CYP1A2TDP1TSHRMAPTALDH1A1 | |
| SCHEMBL9072461 | 0.78 | ALDH1A1 (0.50) | CYP1A2TDP1TSHRMAPTALDH1A1 | |
| SCHEMBL4763859 | 0.78 | ABCB1 (0.43) | TDP1TSHRMAPTALDH1A1KMT2A | |
| SCHEMBL2111433 | 0.75 | MEN1 (0.51) | CYP1A2TSHRALDH1A1KMT2AMEN1 | |
| SCHEMBL20918430 | 0.73 | ALDH1A1 (0.58) | CYP1A2TDP1MAPTALDH1A1KMT2A | |
| SCHEMBL1993159 | 0.71 | CYP1A2 (0.52) | CYP1A2TDP1TSHRMAPTALDH1A1 | |
| SCHEMBL7232887 | 0.70 | TSHR (0.60) | CYP1A2TDP1TSHRALDH1A1KMT2A | |
| SCHEMBL61678 | 0.70 | CYP1A2 (0.60) | CYP1A2TDP1TSHRMAPTALDH1A1 | |
| SCHEMBL8762158 | 0.70 | CYP1A2 (0.55) | CYP1A2TDP1TSHRMAPTALDH1A1 | |
| SCHEMBL31571894 | 0.70 | ALDH1A1 (0.48) | TDP1TSHRMAPTALDH1A1KMT2A |
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-100575330-C | Novel compounds | ASTRAZENECA AB | 2009-12-30 | — | — | CN | disclosed |
| CN-1791572-A | Novel compounds | ASTRAZENECA AB (SE) | 2006-06-21 | — | — | CN | disclosed |