Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EBP | Q15125 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.38 |
| ▸ | BCHE | P06276 | 4/20 | 0.37 |
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7958420 | 0.93 | EBP (0.47) | EBPSIGMAR1BCHETSHRCHRM2 | |
| SCHEMBL7968935 | 0.90 | EBP (0.55) | EBPSIGMAR1TSHRCHRM2HTR1A | |
| SCHEMBL7968756 | 0.89 | EBP (0.47) | EBPSIGMAR1MAOBBCHEACHE | |
| SCHEMBL7965399 | 0.87 | EBP (0.47) | EBPSIGMAR1MAOBBCHEACHE | |
| SCHEMBL7971815 | 0.87 | EBP (0.47) | EBPSIGMAR1MAOBBCHEACHE | |
| SCHEMBL7972043 | 0.86 | SIGMAR1 (0.58) | EBPSIGMAR1MAOBTSHRCHRM2 | |
| SCHEMBL7967023 | 0.86 | EBP (0.55) | EBPSIGMAR1TSHRCHRM2HTR1A | |
| SCHEMBL7968926 | 0.85 | SIGMAR1 (0.48) | EBPSIGMAR1TSHRCHRM2HTR1A | |
| SCHEMBL7968666 | 0.85 | EBP (0.46) | EBPSIGMAR1MAOBBCHEACHE | |
| SCHEMBL7968922 | 0.85 | EBP (0.51) | EBPSIGMAR1MAOBBCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-6265439-B1 | Halogenated phenylacetonitrile alkylaminoalkylphenyl compounds as immunosuppressives | G.D. SEARLE & CO. | 2001-07-24 | — | — | US | disclosed |
| US-5451604-A | Useful in organ transplant surgery | G. D. SEARLE & CO. (US) | 1995-09-19 | — | — | US | disclosed |