Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.30 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.30 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19562363 | 0.83 | KIF11 (0.37) | ALDH1A1TSHRKDM4EPABPC1APOBEC3A | |
| SCHEMBL362964 | 0.82 | TSHR (0.43) | ALDH1A1PTPN1TSHRKDM4EPABPC1 | |
| SCHEMBL8120662 | 0.79 | KCNN4 (0.47) | ALDH1A1PTPN1 | |
| SCHEMBL11077750 | 0.79 | CYP19A1 (0.42) | TSHR | |
| SCHEMBL8129683 | 0.79 | KIF11 (0.41) | ALDH1A1TSHR | |
| Dimethylamine SCHEMBL8511811 | 0.75 | KCNN4 (0.43) | ALDH1A1TSHRKDM4EPABPC1APOBEC3A | |
| SCHEMBL8131087 | 0.75 | KIF11 (0.44) | ALDH1A1 | |
| SCHEMBL11574355 | 0.74 | CYP19A1 (0.49) | TSHRKDM4EPABPC1APOBEC3AAPOBEC3G | |
| Alcohol SCHEMBL7269785 | 0.73 | ALDH1A1 (0.45) | ALDH1A1TSHRKDM4EPABPC1APOBEC3A | |
| SCHEMBL26629595 | 0.73 | ESR1 (0.52) | ALDH1A1TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4082813-A | 3-Ioda-α-ethynyl benzhydrol | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1978-04-04 | — | — | US | disclosed |
| US-4082813-A | 3-Ioda-α-ethynyl benzhydrol | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1978-04-04 | — | — | US | disclosed |
| US-4066709-A | α-Ethyny benzhydrols | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1978-01-03 | — | — | US | disclosed |
| US-3965179-A | BLOCKING, VIRICIDE, FUNGICIDE | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1976-06-22 | — | — | US | disclosed |