Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14154089 | 0.85 | ALDH1A1 (0.62) | ALDH1A1TDP1TSHRCYP3A4MAPT | |
| SCHEMBL7112800 | 0.84 | AKR1C3 (0.49) | ALDH1A1TDP1TSHRCYP3A4VCAM1 | |
| SCHEMBL8094564 | 0.84 | ALDH1A1 (0.53) | ALDH1A1TDP1TSHRCYP3A4VCAM1 | |
| SCHEMBL17630112 | 0.82 | VCAM1 (0.54) | ALDH1A1VCAM1MAPTRAD51KCNJ1 | |
| SCHEMBL3828843 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRCYP3A4MAPT | |
| SCHEMBL22130321 | 0.80 | ALDH1A1 (0.61) | ALDH1A1TDP1TSHRCYP3A4MAPT | |
| SCHEMBL3540919 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRCYP3A4MAPT | |
| SCHEMBL9807396 | 0.80 | ALDH1A1 (0.55) | ALDH1A1TDP1TSHRCYP3A4PTGS2 | |
| SCHEMBL17629951 | 0.79 | LMNA (0.46) | ALDH1A1VCAM1MAPTPTGS2RAD51 | |
| SCHEMBL7112609 | 0.79 | PTGS2 (0.59) | ALDH1A1TDP1TSHRCYP3A4MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1047665-B1 | MATRIX METALLOPROTEASE INHIBITORS | PFIZER LTD (GB) | 2003-10-22 | — | — | EP | disclosed |
| US-6350907-B1 | PEPTIDE ENZYME INHIBITORS | PFIZER INC | 2002-02-26 | — | — | US | disclosed |
| EP-1047665-A1 | MATRIX METALLOPROTEASE INHIBITORS | Pfizer Limited (GB) | 2000-11-02 | — | — | EP | disclosed |
| WO-1999035124-A1 | MATRIX METALLOPROTEASE INHIBITORS | PFIZER LIMITED (GB) | 1999-07-15 | — | — | WO | disclosed |