Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.38 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PDE6D | O43924 | 1/20 | 0.37 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7129939 | 0.87 | TSPO (0.40) | CYP19A1ESR1KMT2ASMN1; SMN2MEN1 | |
| SCHEMBL6820250 | 0.81 | ESR1 (0.47) | CYP19A1ESR1P2RX4KMT2ASMN1; SMN2 | |
| SCHEMBL6471642 | 0.78 | POLB (0.44) | P2RX4KMT2ASMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL6919743 | 0.75 | AGTR1 (0.53) | P2RX4KMT2ASMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL6918965 | 0.75 | CYP19A1 (0.46) | CYP19A1ESR1P2RX4KMT2ASMN1; SMN2 | |
| SCHEMBL6922123 | 0.73 | MAPT (0.41) | KMT2AMAPK1ALDH1A1KDM4EPOLB | |
| SCHEMBL6920639 | 0.72 | PLA2G2A (0.47) | CYP19A1KMT2AMAPK1ALDH1A1KDM4E | |
| SCHEMBL27959994 | 0.71 | CYP19A1 (0.59) | CYP19A1ESR1P2RX4KMT2ASMN1; SMN2 | |
| SCHEMBL6817304 | 0.70 | ESR1 (0.43) | ESR1KDM4ETDP1HTR6MDM2 | |
| SCHEMBL6917019 | 0.70 | ESR1 (0.48) | ESR1KMT2AMEN1ALDH1A1KDM4E |
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-2004048331-A1 | N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS | SUVEN LIFE SCIENCES LIMITED (IN) | 2004-06-10 | — | — | WO | claimed |