Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL6938021 | 0.89 | ALDH1A1 (0.35) | SMN1; SMN2POLBADAM17ALDH1A1 | |
| SCHEMBL6946107 | 0.86 | ADAM17 (0.38) | P2RX3POLBCTSDADAM17 | |
| SCHEMBL6940045 | 0.84 | KMT2A (0.34) | SMN1; SMN2KMT2AHPGDPOLBADAM17 | |
| SCHEMBL6947352 | 0.84 | ADAM17 (0.51) | MEN1KMT2AP2RX3POLBADAM17 | |
| SCHEMBL6939991 | 0.83 | MMP1 (0.42) | MEN1KMT2ACYP2C9POLBADAM17 | |
| SCHEMBL6940054 | 0.83 | CTSK (0.38) | MEN1KMT2APOLBCTSDBACE1 | |
| SCHEMBL6942385 | 0.83 | ADAM17 (0.45) | SMN1; SMN2MEN1KMT2AP2RX3POLB | |
| SCHEMBL8099196 | 0.81 | ADAM17 (0.33) | P2RX3POLBADAM17 | |
| SCHEMBL6945960 | 0.80 | ADAM17 (0.51) | P2RX3ADAM17 | |
| SCHEMBL6946852 | 0.80 | ADAM17 (0.40) | P2RX3POLBADAM17 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0993442-B1 | HYDRAZINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2003-04-23 | — | — | EP | disclosed |
| US-6235787-B1 | ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; BONE DISORDERS; SKIN DISORDERS; MULTIPLE SCLEROSIS | HOFFMANN-LA ROCHE INC. | 2001-05-22 | — | — | US | disclosed |