Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | HSD11B1 | P28845 | 6/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | CCR5 | P51681 | 3/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL12447952 | 0.92 | RAB9A (0.61) | ALDH1A1HSD11B1LMNAHPGDPOLB | |
| SCHEMBL12447948 | 0.87 | CCR5 (0.61) | ALDH1A1HSD11B1LMNAHPGDPOLB | |
| SCHEMBL12447336 | 0.87 | CCR5 (0.61) | ALDH1A1HSD11B1LMNAHPGDPOLB | |
| SCHEMBL27878990 | 0.85 | ALDH1A1 (0.62) | ALDH1A1HSD11B1LMNAHPGDHIF1A | |
| SCHEMBL3312540 | 0.85 | ALDH1A1 (0.62) | ALDH1A1HSD11B1LMNAHPGDHIF1A | |
| SCHEMBL31312243 | 0.84 | KMO (0.61) | ALDH1A1HSD11B1LMNAHPGDHIF1A | |
| SCHEMBL8825970 | 0.84 | ALDH1A1 (0.56) | ALDH1A1HSD11B1LMNAHPGDHIF1A | |
| SCHEMBL8825974 | 0.84 | ALDH1A1 (0.56) | ALDH1A1HSD11B1LMNAHPGDHIF1A | |
| SCHEMBL23009741 | 0.82 | ALDH1A1 (0.59) | ALDH1A1HSD11B1LMNAHPGDHIF1A | |
| SCHEMBL21425067 | 0.82 | ALDH1A1 (0.59) | ALDH1A1HSD11B1LMNAHPGDHIF1A |
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-4382141-A | ANTIDEPRESSANTS, ANALGESICS | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1983-05-03 | — | — | US | disclosed |
| US-4312876-A | CENTRAL NERVOUS SYSTEM | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1982-01-26 | — | — | US | disclosed |