Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6678033 | 0.84 | RAB9A (0.45) | ALDH1A1TSHRMAPTKDM4EKMT2A | |
| SCHEMBL8577254 | 0.84 | RAB9A (0.45) | ALDH1A1TSHRMAPTKDM4EKMT2A | |
| SCHEMBL14378542 | 0.81 | FFAR1 (0.45) | ALDH1A1TSHRCYP4F2CYP4A11POLB | |
| SCHEMBL14378544 | 0.81 | FFAR1 (0.45) | ALDH1A1TSHRCYP4F2CYP4A11POLB | |
| SCHEMBL3449610 | 0.81 | FFAR1 (0.45) | ALDH1A1TSHRCYP4F2CYP4A11POLB | |
| SCHEMBL1519580 | 0.75 | TP53 (0.46) | ALDH1A1CYP4F2CYP4A11POLBHPGD | |
| SCHEMBL22070557 | 0.74 | TP53 (0.45) | ALDH1A1TSHRPOLBMAPTKDM4E | |
| SCHEMBL10148374 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHRPOLBHPGDMAPT | |
| SCHEMBL7527688 | 0.73 | KDM4C (0.41) | ALDH1A1TSHRCYP4F2CYP4A11POLB | |
| SCHEMBL7127498 | 0.73 | ALDH1A1 (0.49) | ALDH1A1TSHRCYP4F2CYP4A11POLB |
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-1998055475-A1 | GUANIDINE DERIVIATIVES AS INHIBITORS OF NA+/H+ EXCHANGE IN CELLS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1998-12-10 | — | — | WO | disclosed |