Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 2/20 | 0.58 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.51 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL1516137 | 0.84 | NPC1 (0.75) | NPC1RAB9AALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL4810294 | 0.83 | CRHBP (0.61) | CRHBPCRHR2SIGMAR1ALDH1A1LMNA | |
| SCHEMBL27448293 | 0.83 | CRHBP (0.57) | CRHBPCRHR2SIGMAR1NPC1RAB9A | |
| SCHEMBL14415489 | 0.82 | SIGMAR1 (0.61) | CRHBPCRHR2SIGMAR1ALDH1A1LMNA | |
| SCHEMBL4421574 | 0.82 | NPC1 (0.66) | NPC1RAB9AALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL8789867 | 0.81 | ALDH1A1 (0.77) | CRHBPCRHR2NPC1RAB9AALDH1A1 | |
| SCHEMBL8790300 | 0.81 | CRHBP (0.51) | CRHBPCRHR2SIGMAR1NPC1RAB9A | |
| SCHEMBL14415479 | 0.80 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1LMNASMN1; SMN2OPRK1 | |
| SCHEMBL3804808 | 0.80 | SIGMAR1 (0.58) | CRHBPCRHR2SIGMAR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL3143221 | 0.80 | CRHBP (0.71) | CRHBPCRHR2SIGMAR1ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0782567-B2 | ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | ASTRA AB (SE) | 2002-12-11 | — | — | EP | disclosed |
| EP-0782567-B1 | ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | ASTRA AB (SE) | 1999-06-30 | — | — | EP | disclosed |
| US-5721247-A | Isothiourea derivatives useful in therapy | ASTRA AKTIEBOLAG (SE) | 1998-02-24 | — | — | US | disclosed |
| EP-0782567-A1 | ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | Astra Aktiebolag (SE) | 1997-07-09 | — | — | EP | disclosed |
| WO-1996009286-A1 | ISOTHIOUREA DERIVATIVES AS NO SYNTHASE INHIBITORS | ASTRA AKTIEBOLAG (SE) | 1996-03-28 | — | — | WO | disclosed |