Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL3562174 | 1.00 | ALDH1A1 (0.56) | ALDH1A1LMNAHPGDTAAR1SLC6A2 | |
| SCHEMBL10421296 | 0.92 | HDAC1 (0.52) | ALDH1A1LMNAHPGDTAAR1SLC6A2 | |
| SCHEMBL3559805 | 0.91 | ALDH1A1 (0.55) | ALDH1A1LMNAHPGDTAAR1SLC6A2 | |
| SCHEMBL13037180 | 0.91 | ALDH1A1 (0.55) | ALDH1A1LMNAHPGDTAAR1SLC6A2 | |
| SCHEMBL29673912 | 0.88 | ALDH1A1 (0.57) | ALDH1A1LMNAHPGDSMN1; SMN2RAB9A | |
| SCHEMBL29673906 | 0.88 | ALDH1A1 (0.57) | ALDH1A1LMNAHPGDSMN1; SMN2RAB9A | |
| Hydrochloric Acid SCHEMBL27032751 | 0.83 | LMNA (0.56) | ALDH1A1LMNATAAR1SMN1; SMN2RAB9A | |
| Hydrochloric Acid SCHEMBL27129903 | 0.83 | LMNA (0.56) | ALDH1A1LMNATAAR1SMN1; SMN2RAB9A | |
| SCHEMBL11744707 | 0.82 | HSD17B10 (0.70) | ALDH1A1LMNAHPGDSMN1; SMN2RAB9A | |
| SCHEMBL4741336 | 0.82 | LMNA (0.57) | ALDH1A1LMNATAAR1SMN1; SMN2RAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7825256-B2 | Inducible nitric oxide synthase dimerization inhibitors | KALYPSYS, INC. (US) | 2010-11-02 | — | — | US | disclosed |
| US-7825256-B2 | Inducible nitric oxide synthase dimerization inhibitors | KALYPSYS, INC. (US) | 2010-11-02 | — | — | US | disclosed |
| US-7825256-B2 | Inducible nitric oxide synthase dimerization inhibitors | KALYPSYS, INC. (US) | 2010-11-02 | — | — | US | disclosed |
| EP-1817030-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | Kalypsys, Inc. (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006060424-A2 | INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS | KALYPSYS, INC. (US) | 2006-06-08 | — | — | WO | disclosed |