Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 9/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | GFER | P55789 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 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 | |
|---|---|---|---|---|
| SCHEMBL11457094 | 0.88 | ALDH1A1 (0.54) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11454382 | 0.88 | ALDH1A1 (0.49) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11465422 | 0.87 | GFER (0.50) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11454629 | 0.87 | ALDH1A1 (0.52) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11447284 | 0.87 | KMT2A (0.53) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11465438 | 0.87 | ALDH1A1 (0.53) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11446599 | 0.87 | ADRA1D (0.51) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| Hydrochloric Acid SCHEMBL11457400 | 0.86 | ADRA1D (0.53) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11446664 | 0.84 | ALDH1A1 (0.53) | ALDH1A1LMNAKMT2AMEN1TSHR | |
| SCHEMBL11447378 | 0.84 | ALDH1A1 (0.46) | ALDH1A1LMNAKMT2AMEN1TSHR |
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-4205173-A | 1-Heterocyclic alkyl-1,2,3,4-tetrahydroquinazolinones and analgesic intermediates thereof | PENNWALT CORPORATION (US) | 1980-05-27 | — | — | US | disclosed |
| US-4085107-A | ANALGESICS | PENNWALT CORPORATION (US) | 1978-04-18 | — | — | US | disclosed |
| US-4060526-A | 1-Heterocyclic alkyl-1,2,3,4-tetrahydroquinazolinones and analgesic intermediates thereof | PENNWALT CORPORATION (US) | 1977-11-29 | — | — | US | disclosed |