Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 5/20 | 0.34 |
| ▸ | UBE2M | P61081 | 6/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 6/20 | 0.33 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.33 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.33 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8429031 | 0.91 | TACR1 (0.35) | TACR1UBE2MDCUN1D1SCN9ATRPA1 | |
| SCHEMBL8429153 | 0.87 | SIRT2 (0.37) | USP2 | |
| SCHEMBL8429203 | 0.87 | TACR1 (0.33) | TACR1UBE2MDCUN1D1TRPA1PPARG | |
| SCHEMBL8429096 | 0.80 | UBE2M (0.38) | TACR1UBE2MDCUN1D1TRPA1PPARG | |
| SCHEMBL8431034 | 0.79 | ALDH1A1 (0.41) | UBE2MDCUN1D1USP2 | |
| SCHEMBL7375612 | 0.79 | TRPA1 (0.38) | TACR1UBE2MDCUN1D1TRPA1USP2 | |
| SCHEMBL7375074 | 0.79 | TRPA1 (0.38) | TACR1UBE2MDCUN1D1TRPA1USP2 | |
| SCHEMBL8431230 | 0.79 | RAB9A (0.40) | USP2ADRB1 | |
| SCHEMBL8430957 | 0.78 | PLAU (0.38) | UBE2MDCUN1D1USP2 | |
| SCHEMBL8432438 | 0.78 | RAB9A (0.37) | USP2 |
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-5952381-A | SELECTIVELY INHIBITING OR ANTAGONIZING THE INTEGRINS; ANTITUMOR AGENTS, ANTIARTHRITIC AGENTS, VIRICIDES, MICROBIOCIDES; TREATING OSTEOPOROSIS, SKIN DISORDERS | G. D. SEARLE & CO. (US) | 1999-09-14 | — | — | US | claimed |
| US-5952381-A | SELECTIVELY INHIBITING OR ANTAGONIZING THE INTEGRINS; ANTITUMOR AGENTS, ANTIARTHRITIC AGENTS, VIRICIDES, MICROBIOCIDES; TREATING OSTEOPOROSIS, SKIN DISORDERS | G. D. SEARLE & CO. (US) | 1999-09-14 | — | — | US | disclosed |