Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8931145 | 0.99 | APLNR (0.61) | APLNRMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL8931146 | 0.89 | HIF1A (0.48) | APLNRMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL8931156 | 0.84 | MEN1 (0.58) | MEN1KMT2AALDH1A1KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL8931155 | 0.83 | MEN1 (0.57) | MEN1KMT2AALDH1A1KDM4EPOLB | |
| SCHEMBL9351069 | 0.79 | ADRA1A (0.51) | MEN1KMT2AHTR2AHTR2C | |
| SCHEMBL783785 | 0.79 | APLNR (1.00) | APLNRMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL17501789 | 0.79 | APLNR (0.73) | APLNRMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL8880359 | 0.79 | APLNR (0.78) | APLNRMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL21159301 | 0.78 | APLNR (0.83) | APLNRMEN1KMT2AALDH1A1PKM | |
| Hydrochloric Acid SCHEMBL11092397 | 0.77 | APLNR (0.76) | APLNRMEN1KMT2AHTR2AHTR2C |
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-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 |