Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | APLNR | P35414 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9229255 | 0.89 | APLNR (0.63) | APLNRHTR2AKMT2AHTR2CMEN1 | |
| Hydrochloric Acid SCHEMBL8931145 | 0.88 | APLNR (0.61) | APLNRHTR2AKMT2AHTR2CMEN1 | |
| SCHEMBL9351069 | 0.87 | ADRA1A (0.51) | HTR2AKMT2AHTR2CMEN1IDO1 | |
| SCHEMBL8931156 | 0.84 | MEN1 (0.58) | KMT2AMEN1ALDH1A1KDM4ETP53 | |
| Hydrochloric Acid SCHEMBL8931155 | 0.83 | MEN1 (0.57) | KMT2AMEN1SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL2900357 | 0.76 | HTT (0.58) | KMT2AMEN1HTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL10032817 | 0.75 | HTR2A (0.62) | HTR2AKMT2AHTR2CMEN1SMN1; SMN2 | |
| SCHEMBL14299916 | 0.75 | APLNR (0.61) | APLNRHTR2AKMT2AHTR2CMEN1 | |
| SCHEMBL9351081 | 0.74 | CYP2D6 (0.54) | KMT2AMEN1ADRA1AHTTALDH1A1 | |
| SCHEMBL2891401 | 0.73 | HTT (0.46) | KMT2AMEN1HTTSMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2614408-B2 | — | — | 1997-05-28 | — | — | JP | claimed |
| WO-1993010073-A1 | ACYCLIC ETHYLENEDIAMINE DERIVATIVES AS SUBSTANCE P RECEPTOR ANTAGONISTS | PFIZER INC. (US) | 1993-05-27 | — | — | WO | claimed |
| US-5521220-A | Acyclic ethylenediamine derivatives | PFIZER INC. (US) | 1996-05-28 | — | — | US | disclosed |
| EP-0613458-A1 | ACYCLIC ETHYLENEDIAMINE DERIVATIVES AS SUBSTANCE P RECEPTOR ANTAGONISTS | PFIZER INC. (US) | 1994-09-07 | — | — | EP | disclosed |
| WO-1993010073-A1 | ACYCLIC ETHYLENEDIAMINE DERIVATIVES AS SUBSTANCE P RECEPTOR ANTAGONISTS | PFIZER INC. (US) | 1993-05-27 | — | — | WO | disclosed |