Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.70 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.70 |
| ▸ | SSTR5 | P35346 | 8/20 | 0.65 |
| ▸ | HRH1 | P35367 | 5/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.51 |
| ▸ | EED | O75530 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | HTR3A | P46098 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | MLNR | O43193 | 1/20 | 0.51 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | HLA-A | P04439 | 1/20 | 0.51 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7861587 | 1.00 | KCNH2 (0.70) | KCNH2NR4A2SSTR5HRH1CHRM1 | |
| SCHEMBL7865206 | 0.84 | KCNH2 (0.48) | KCNH2NR4A2SSTR5HRH1CHRM1 | |
| SCHEMBL7865204 | 0.84 | KCNH2 (0.48) | KCNH2NR4A2SSTR5HRH1CHRM1 | |
| SCHEMBL7860380 | 0.83 | KCNH2 (0.48) | KCNH2NR4A2SSTR5MAPTHTT | |
| SCHEMBL7860383 | 0.83 | KCNH2 (0.48) | KCNH2NR4A2SSTR5MAPTHTT | |
| Tecastemizole SCHEMBL18200 | 0.83 | KCNH2 (1.00) | KCNH2NR4A2SSTR5HRH1CHRM1 | |
| SCHEMBL7860295 | 0.82 | KCNH2 (0.43) | KCNH2NR4A2SSTR5LMNAKMT2A | |
| SCHEMBL7860293 | 0.82 | KCNH2 (0.43) | KCNH2NR4A2SSTR5LMNAKMT2A | |
| Tecastemizole SCHEMBL9698437 | 0.82 | KCNH2 (0.98) | KCNH2NR4A2SSTR5HRH1CHRM1 | |
| Tecastemizole SCHEMBL11278980 | 0.82 | KCNH2 (0.98) | KCNH2NR4A2SSTR5HRH1CHRM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0869955-B1 | N-ACYL-2-SUBSTITUTED-4-(BENZIMIDAZOLYL- OR IMIDAZOPYRIDINYL-SUBSTITUTED RESIDUES)-PIPERIDINES AS TACHYKININ ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2001-10-24 | — | — | EP | disclosed |
| US-6110939-A | AS A SUBSTANCE P ANTAGONISTS TREATING TACHYKININ-MEDIATED DISEASE, ASTHMA, CENTRAL NERVOUS SYSTEM DISORDER | JANSSEN PHARMACEUTICA N.V. (BE) | 2000-08-29 | — | — | US | disclosed |