Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.44 |
| ▸ | MDM4 | O15151 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28956510 | 0.81 | RAB9A (0.67) | RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1 | |
| SCHEMBL7426387 | 0.81 | ALDH1A1 (0.51) | RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1 | |
| SCHEMBL10555654 | 0.81 | RAB9A (1.00) | RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1 | |
| SCHEMBL10554822 | 0.80 | RAB9A (0.62) | RAB9AALDH1A1SMN1; SMN2NPC1TSHR | |
| SCHEMBL10556386 | 0.77 | ALDH1A1 (0.50) | RAB9AALDH1A1SMN1; SMN2NPC1TP53 | |
| SCHEMBL10334137 | 0.76 | ALDH1A1 (0.45) | RAB9AALDH1A1SMN1; SMN2TSHRKDM4E | |
| SCHEMBL9619258 | 0.75 | RAB9A (0.42) | RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1 | |
| SCHEMBL10647510 | 0.75 | ALDH1A1 (0.46) | RAB9AALDH1A1SMN1; SMN2TSHRKDM4E | |
| SCHEMBL10556187 | 0.74 | MAPT (0.45) | RAB9AALDH1A1HSD17B10SMN1; SMN2TSHR | |
| SCHEMBL11752599 | 0.73 | RAB9A (1.00) | RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4778801-A | ANTIANXIETY DRUGS FOR PSYCHOSOMATIC DISEASE WITH LITTLE SIDE EFFECTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1988-10-18 | — | — | US | disclosed |
| US-4695572-A | Isoindolinone derivatives, production and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1987-09-22 | — | — | US | disclosed |
| EP-0174858-A1 | Isoindolinone derivatives, production and use thereof | Takeda Chemical Industries, Ltd. (JP) | 1986-03-19 | — | — | EP | disclosed |