Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.39 |
| ▸ | RARB | P10826 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.38 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8324645 | 0.80 | ALDH1A1 (0.36) | RAB9ATP53HSD17B10ALDH1A1HPGD | |
| Terephthalic Acid SCHEMBL4612225 | 0.73 | TSHR (0.67) | SMN1; SMN2TP53NAPRTALDH1A1RARB | |
| SCHEMBL70166 | 0.73 | TSHR (0.67) | SMN1; SMN2TP53NAPRTALDH1A1RARB | |
| SCHEMBL6257548 | 0.72 | KDM6B (0.46) | NPC1RAB9ASMN1; SMN2HSD17B10NAPRT | |
| SCHEMBL16687966 | 0.71 | ALDH1A1 (0.54) | TP53ALDH1A1RARBP2RX3TSHR | |
| SCHEMBL5751057 | 0.71 | TSHR (0.74) | NPC1RAB9ASMN1; SMN2TP53HSD17B10 | |
| Hydrochloric Acid SCHEMBL7132238 | 0.71 | TSHR (0.63) | TP53NAPRTALDH1A1RARBP2RX3 | |
| SCHEMBL907669 | 0.71 | KDM4E (0.37) | NFKB1NAPRTALDH1A1TSHRHCAR2 | |
| SCHEMBL8320778 | 0.71 | RARB (0.42) | NPC1RAB9ASMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL6769826 | 0.70 | NAPRT (0.64) | NPC1RAB9ASMN1; SMN2TP53NAPRT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733033-B1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LTD (GB) | 1999-12-22 | — | — | EP | disclosed |
| EP-0733033-A1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LIMITED (GB) | 1996-09-25 | — | — | EP | disclosed |
| WO-1996011902-A1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LIMITED (GB) | 1996-04-25 | — | — | WO | disclosed |