Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UBE2N | P61088 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 4/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11600553 | 0.92 | ESR1 (0.55) | ALDH1A1KDM4EPSMB1PSMB5ESR1 | |
| SCHEMBL11601598 | 0.84 | KDM4E (0.53) | ALDH1A1KDM4EPSMB1PSMB5ESR1 | |
| SCHEMBL11598939 | 0.82 | UBE2N (0.61) | UBE2NNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL11601880 | 0.82 | ESR1 (0.59) | PSMB1PSMB5DRD3ESR1ESR2 | |
| SCHEMBL11600648 | 0.81 | ALDH1A1 (0.45) | NPC1RAB9AALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL11623971 | 0.80 | UBE2N (0.53) | UBE2NNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL11602118 | 0.80 | UBE2N (0.44) | UBE2NNPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL11553642 | 0.79 | ESR1 (0.56) | DRD3ESR1ESR2LTA4H | |
| SCHEMBL11600056 | 0.78 | LTA4H (0.56) | UBE2NALDH1A1ACHEDRD3ESR1 | |
| SCHEMBL11599995 | 0.78 | LTA4H (0.53) | ALDH1A1KDM4EPSMB1PSMB5ESR1 |
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-4075227-A | NONSTEROIDAL | ELI LILLY AND COMPANY (US) | 1978-02-21 | — | — | US | disclosed |