Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX4 | Q99571 | 4/20 | 0.54 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.43 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | OXTR | P30559 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL8788236 | 0.81 | HSD17B3 (0.53) | P2RX4ALDH1A1HSD17B3KMT2AMEN1 | |
| SCHEMBL9172696 | 0.81 | MEN1 (0.65) | P2RX4ALDH1A1POLBKMT2AMEN1 | |
| SCHEMBL7342110 | 0.79 | HPGD (0.63) | HPGDALDH1A1HSD17B3AVPR2AVPR1A | |
| SCHEMBL6988456 | 0.78 | HSD17B3 (0.69) | P2RX4ALDH1A1HSD17B3KMT2AMEN1 | |
| SCHEMBL11392727 | 0.77 | MAPT (0.44) | P2RX4ALDH1A1POLBKMT2AMEN1 | |
| SCHEMBL7337255 | 0.77 | AVPR2 (0.63) | AVPR2AVPR1AOXTR | |
| SCHEMBL1366112 | 0.74 | HSD17B3 (0.49) | P2RX4ALDH1A1HSD17B3KMT2AMEN1 | |
| SCHEMBL9174411 | 0.74 | MEN1 (0.60) | P2RX4ALDH1A1POLBKMT2AMEN1 | |
| Benzophenone SCHEMBL28148992 | 0.74 | MAOA (0.65) | P2RX4HPGDALDH1A1KMT2AMEN1 | |
| SCHEMBL8563252 | 0.74 | TP53 (0.47) | MAPT |
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-1996022282-A1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | AMERICAN CYANAMID COMPANY (US) | 1996-07-25 | — | — | WO | disclosed |