Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.58 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.51 |
| ▸ | CETP | P11597 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.47 |
| ▸ | HTR3B | O95264 | 3/20 | 0.47 |
| ▸ | HTR3A | P46098 | 3/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.47 |
| ▸ | TACR2 | P21452 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL177143 | 1.00 | S1PR1 (0.58) | S1PR1ADRB1CETPFAAHMGLL | |
| Bromide SCHEMBL7337699 | 0.98 | S1PR1 (0.57) | S1PR1ADRB1CETPFAAHMGLL | |
| SCHEMBL5717512 | 0.98 | S1PR1 (0.56) | S1PR1ADRB1CETPFAAHMGLL | |
| SCHEMBL3716245 | 0.93 | CETP (0.57) | S1PR1ADRB1CETPHTR3EHTR3B | |
| SCHEMBL12436513 | 0.88 | S1PR1 (0.70) | S1PR1FAAHMGLLSIGMAR1ESR1 | |
| SCHEMBL3637251 | 0.86 | ADRB1 (0.58) | ADRB1CETPMGLLHTR3EHTR3B | |
| SCHEMBL21280348 | 0.83 | S1PR1 (0.61) | S1PR1FAAHMGLLESR1ADRA2A | |
| SCHEMBL30459591 | 0.82 | ADRB1 (0.53) | ADRB1CETPHTR3EHTR3BHTR3A | |
| SCHEMBL7433560 | 0.82 | ADRB1 (0.49) | ADRB1CETPHTR3EHTR3BHTR3A | |
| SCHEMBL19245042 | 0.82 | S1PR1 (0.59) | S1PR1FAAHMGLLESR1ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1203089-C | New compound | FUJISAWA PHARMACEUTICAL CO (JP) | 2005-05-25 | — | — | CN | disclosed |
| CN-1168675-A | Novel compounds | FUJISAWA PHARMACEUTICAL CO (JP) | 1997-12-24 | — | — | CN | disclosed |