Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SPR | P35270 | 1/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.42 |
| ▸ | ADAMTS5 | Q9UNA0 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11247608 | 0.90 | ESR1 (0.48) | ESR1PARP1KMT2ATACR1ADAMTS5 | |
| SCHEMBL11239440 | 0.88 | KMT2A (0.53) | MCHR1ESR1MEN1KMT2A | |
| SCHEMBL11239836 | 0.88 | ESR1 (0.56) | ESR1PARP1KMT2APKM | |
| SCHEMBL11347461 | 0.87 | ALDH1A1 (0.53) | ESR1KMT2APOLBHSD11B1 | |
| SCHEMBL11222496 | 0.85 | ESR1 (0.51) | AVPR1AESR1PARP1MEN1KMT2A | |
| SCHEMBL11223947 | 0.80 | AVPR1A (0.62) | AVPR1AMCHR1ESR1OPRM1OPRK1 | |
| SCHEMBL11239643 | 0.77 | ESR1 (0.57) | ESR1PARP1ADAMTS5 | |
| SCHEMBL11351356 | 0.76 | ESR1 (0.54) | ESR1PARP1ADAMTS5 | |
| SCHEMBL11231076 | 0.74 | ESR1 (0.52) | MCHR1ESR1PARP1TACR1POLB | |
| SCHEMBL11351370 | 0.74 | ESR1 (0.52) | ESR1PARP1MEN1KMT2ATACR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4251538-A | Indolealkylamines and processes for their preparation | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-02-17 | — | — | US | disclosed |
| EP-0007399-A1 | Indolylalkyl amines, pharmaceutical preparations containing them and process for their manufacture | MERCK PATENT GmbH (DE) | 1980-02-06 | — | — | EP | disclosed |