Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.50 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PHGDH | O43175 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11329074 | 0.89 | MAPK1 (0.51) | POLBKMT2AALDH1A1HTTLMNA | |
| SCHEMBL9822593 | 0.89 | VCAM1 (0.51) | NR4A1POLBVCAM1KMT2AALDH1A1 | |
| SCHEMBL11321781 | 0.88 | AKR1C3 (0.47) | POLBVCAM1KMT2AALDH1A1HTT | |
| SCHEMBL7454932 | 0.87 | VCAM1 (0.47) | NR4A1POLBVCAM1KMT2AALDH1A1 | |
| SCHEMBL11002006 | 0.87 | LMNA (0.47) | VCAM1KMT2AALDH1A1LMNANPC1 | |
| SCHEMBL11504583 | 0.85 | KMT2A (0.45) | POLBVCAM1KMT2AALDH1A1LMNA | |
| SCHEMBL11334972 | 0.84 | KMT2A (0.65) | POLBKMT2AALDH1A1HTTLMNA | |
| Toluene SCHEMBL28103286 | 0.82 | VCAM1 (0.46) | POLBVCAM1KMT2AHTTLMNA | |
| SCHEMBL11335006 | 0.82 | RECQL (0.48) | POLBKMT2AALDH1A1HTTLMNA | |
| SCHEMBL11325159 | 0.80 | NR4A1 (0.47) | NR4A1BCL2L1POLBVCAM1ALDH1A1 |
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-4254146-A | ANTIINFLAMMATORY AGENTS | A. H. ROBINS COMPANY, INC. (US) | 1981-03-03 | — | — | US | disclosed |