Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9459073 | 0.81 | CYP2D6 (0.37) | CYP2D6HSD17B1KMT2APOLBKDM4E | |
| SCHEMBL1254599 | 0.79 | CYP2D6 (0.49) | CYP2D6HSD17B1KMT2APOLBALDH1A1 | |
| SCHEMBL3320253 | 0.78 | TLR4 (0.56) | TLR4 | |
| SCHEMBL534241 | 0.78 | CYP2D6 (0.55) | CYP2D6KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL11241585 | 0.78 | CYP2D6 (0.55) | CYP2D6KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL11082604 | 0.76 | CYP2D6 (0.54) | CYP2D6KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL10412651 | 0.76 | CYP2D6 (0.54) | CYP2D6KMT2APOLBKDM4EALDH1A1 | |
| SCHEMBL6023505 | 0.75 | CYP2D6 (0.37) | CYP2D6HSD17B1KMT2APOLBALDH1A1 | |
| SCHEMBL6929499 | 0.74 | L3MBTL1 (0.47) | KMT2AKDM4EALDH1A1GAACYP1A2 | |
| SCHEMBL171063 | 0.74 | TLR4 (0.55) | TLR4CYP2D6KMT2AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4478837-A | HYPOTENSIVE AGENTS | SANDOZ LTD. (CH) | 1984-10-23 | — | — | US | disclosed |
| US-3954754-A | ANTIHYPERTENSIVES | SANDOZ LTD. (CH) | 1976-05-04 | — | — | US | disclosed |