Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.59 |
| ▸ | RXRB | P28702 | 1/20 | 0.59 |
| ▸ | ABL1 | P00519 | 2/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.58 |
| ▸ | BCR | P11274 | 2/20 | 0.58 |
| ▸ | MAOB | P27338 | 2/20 | 0.53 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.50 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.50 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.50 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.50 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8470898 | 0.93 | RXRA (0.64) | RXRARXRBABL1ABCB1BCR | |
| SCHEMBL1180412 | 0.85 | ABL1 (0.77) | ABL1ABCB1BCRMAOBCYP1A1 | |
| SCHEMBL792197 | 0.85 | ABL1 (0.77) | ABL1ABCB1BCRMAOBCYP1A1 | |
| SCHEMBL1180343 | 0.84 | ABL1 (0.69) | ABL1ABCB1BCRMAOBCYP1A1 | |
| SCHEMBL1181204 | 0.83 | ABL1 (0.81) | ABL1ABCB1BCRMAOBCYP1A1 | |
| SCHEMBL21202067 | 0.82 | ESR2 (0.54) | ABL1ABCB1BCRMAOBPTPN5 | |
| SCHEMBL8469211 | 0.81 | RXRA (0.72) | RXRARXRBMAOBCYP1A2CYP3A4 | |
| SCHEMBL9414212 | 0.81 | ABL1 (0.66) | ABL1ABCB1BCRMAOBCYP1A1 | |
| SCHEMBL13247865 | 0.81 | ABL1 (0.64) | ABL1ABCB1BCRMAOBCYP1A1 | |
| SCHEMBL178565 | 0.81 | NPSR1 (0.57) | RXRARXRBCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999025707-A1 | 2-ARYLBENZO[b]THIOPHENES USEFUL FOR THE TREATMENT OF ESTROGEN DEPRIVATION SYNDROME | ELI LILLY AND COMPANY (US) | 1999-05-27 | — | — | WO | claimed |