Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL5212613 | 0.87 | S100A4 (0.44) | S100A4TRPV1ACHERAB9AMEN1 | |
| SCHEMBL3526726 | 0.81 | KMT2A (0.53) | S100A4TRPV1RAB9AMEN1KMT2A | |
| SCHEMBL1199050 | 0.80 | S100A4 (0.46) | S100A4TRPV1ACHERAB9ACYP1A2 | |
| SCHEMBL29561732 | 0.80 | S100A4 (0.46) | S100A4TRPV1ACHERAB9ACYP1A2 | |
| SCHEMBL559763 | 0.80 | PDK1 (0.51) | S100A4TRPV1ACHERAB9ACYP1A2 | |
| SCHEMBL961045 | 0.79 | S100A4 (0.45) | S100A4TRPV1ACHERAB9AMEN1 | |
| SCHEMBL14756219 | 0.79 | TSHR (0.56) | S100A4TRPV1ACHERAB9ACYP1A2 | |
| SCHEMBL29291499 | 0.79 | S100A4 (0.45) | S100A4TRPV1ACHERAB9ACYP1A2 | |
| SCHEMBL31272132 | 0.79 | S100A4 (0.45) | S100A4TRPV1ACHERAB9AMEN1 | |
| SCHEMBL3526369 | 0.79 | S100A4 (0.45) | S100A4TRPV1ACHERAB9ACYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7642276-B2 | Fused heteroaryl derivatives for use as P38 kinase inhibitors | SMITHKLINE BEECHAM CORPORATION (US) | 2010-01-05 | — | — | US | disclosed |