Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | UBE2M | P61081 | 4/20 | 0.35 |
| ▸ | DCUN1D1 | Q96GG9 | 4/20 | 0.35 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.32 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.32 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8431176 | 0.89 | UBE2M (0.34) | UBE2MDCUN1D1RXFP1CNR2ALDH1A1 | |
| SCHEMBL8429207 | 0.81 | P2RX1 (0.36) | TRPA1CYP1A2P2RX1MAPTL3MBTL1 | |
| SCHEMBL8430805 | 0.81 | DHODH (0.33) | CYP1A2UBE2MDCUN1D1RXFP1CNR2 | |
| SCHEMBL8428876 | 0.80 | P2RX1 (0.35) | TRPA1CYP1A2P2RX1ALDH1A1AKR1C3 | |
| SCHEMBL8429040 | 0.78 | P2RX1 (0.34) | TRPA1CYP1A2P2RX1ALDH1A1AKR1C3 | |
| SCHEMBL8429290 | 0.75 | CA1 (0.33) | CYP1A2MAPTRXFP1ALDH1A1HTT | |
| SCHEMBL8430880 | 0.73 | CA1 (0.37) | RXFP1ALDH1A1 | |
| SCHEMBL8429100 | 0.71 | BCHE (0.34) | TRPA1CYP1A2UBE2MDCUN1D1L3MBTL1 | |
| SCHEMBL8431037 | 0.70 | DHODH (0.37) | MAPTALDH1A1 | |
| SCHEMBL8430809 | 0.69 | CA1 (0.32) | MAPTALDH1A1HTT |
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 1 patent. 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 | disclosed |