Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIG1 | P18858 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9706058 | 0.87 | GAA (0.55) | MAPTGAALMNAHPGDHTT | |
| SCHEMBL5557530 | 0.85 | MAPT (0.74) | LIG1MAPTGAALMNAESR1 | |
| SCHEMBL112508 | 0.85 | MAPT (0.74) | MAPTGAALMNAABCB11PTGS1 | |
| Benzene SCHEMBL28303083 | 0.85 | MAPT (0.74) | MAPTGAALMNAABCB11PTGS1 | |
| SCHEMBL29786713 | 0.85 | MAPT (0.74) | MAPTGAALMNAABCB11PTGS1 | |
| SCHEMBL6355277 | 0.84 | G6PD (0.56) | LIG1MAPTGAALMNAESR1 | |
| SCHEMBL7743794 | 0.84 | MAPT (0.52) | MAPTGAALMNAABCB11PTGS1 | |
| SCHEMBL28282156 | 0.83 | MAPT (0.71) | MAPTGAALMNAABCB11PTGS1 | |
| SCHEMBL686612 | 0.82 | MAPT (0.50) | MAPTGAALMNAHPGDABCB11 | |
| Benzophenone SCHEMBL27604625 | 0.80 | MAPT (0.79) | LIG1MAPTGAALMNAESR1 |
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-5093495-A | Benzoheterocyclic compounds | SHELL OIL COMPANY (US) | 1992-03-03 | — | — | US | disclosed |
| US-5071996-A | Benzheterocyclic compounds | SHELL OIL COMPANY (US) | 1991-12-10 | — | — | US | disclosed |