Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.36 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.36 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3848571 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1RAB9ALMNA | |
| SCHEMBL10511811 | 0.76 | MAPT (0.54) | ALDH1A1TSHRTDP1L3MBTL1RAB9A | |
| SCHEMBL12493341 | 0.72 | TSHR (0.47) | ALDH1A1TSHRTDP1L3MBTL1RAB9A | |
| SCHEMBL769363 | 0.71 | TSHR (0.62) | ALDH1A1TSHRL3MBTL1HPGDKDM4E | |
| SCHEMBL18551135 | 0.70 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1L3MBTL1LMNA | |
| SCHEMBL2554577 | 0.69 | TSHR (0.47) | ALDH1A1TSHRTDP1L3MBTL1LMNA | |
| SCHEMBL4977454 | 0.69 | KMT2A (0.53) | ALDH1A1TSHRTDP1RAB9ALMNA | |
| SCHEMBL3185725 | 0.69 | TDP1 (0.68) | ALDH1A1TSHRTDP1MAPT | |
| SCHEMBL27498764 | 0.69 | TSHR (0.59) | ALDH1A1TSHRL3MBTL1HPGDKDM4E | |
| SCHEMBL236201 | 0.69 | ALDH1A1 (0.56) | ALDH1A1TSHRL3MBTL1RAB9AHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1140895-A2 | THIOPYRAN COMPOUNDS AS INHIBITORS OF MMP | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000040576-A2 | THIOPYRAN COMPOUNDS AS INHIBITORS OF MMP | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-07-13 | — | — | WO | disclosed |