Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11749806 | 1.00 | CACNA2D1 (0.38) | CACNA2D1MAPTTP53ALDH1A1XDH | |
| SCHEMBL11751106 | 0.88 | TP53 (0.45) | CACNA2D1MAPTTP53ALDH1A1XDH | |
| SCHEMBL11749947 | 0.87 | NUDT1 (0.35) | ALDH1A1LMNANPSR1KDM4ESMN1; SMN2 | |
| SCHEMBL11743305 | 0.82 | MAPT (0.34) | MAPTTP53ALDH1A1LMNAKDM4E | |
| SCHEMBL11750140 | 0.82 | MAPT (0.34) | MAPTTP53ALDH1A1LMNAKDM4E | |
| SCHEMBL11741147 | 0.76 | MAPT (0.44) | CACNA2D1MAPTTP53ALDH1A1MEN1 | |
| SCHEMBL11881563 | 0.75 | NQO1 (0.61) | MAPTTP53ALDH1A1KDM4ENPC1 | |
| SCHEMBL2320897 | 0.74 | MAPT (0.37) | CACNA2D1MAPTTP53ALDH1A1XDH | |
| SCHEMBL11745513 | 0.73 | CA12 (0.33) | — | |
| SCHEMBL11747582 | 0.73 | L3MBTL1 (0.37) | MAPTALDH1A1MEN1KMT2ALMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4008232-A | ANTIINFLAMMATORY | ELI LILLY AND COMPANY (US) | 1977-02-15 | — | — | US | disclosed |
| US-3979516-A | Anti-inflammatory 3-amino-5,6-diaryl-1,2,4-triazines | ELI LILLY AND COMPANY (US) | 1976-09-07 | — | — | US | disclosed |
| US-3948894-A | ANTIINFLAMMATORY | ELI LILLY AND COMPANY (US) | 1976-04-06 | — | — | US | disclosed |